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Azoles

Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Imidazoles (25)
Thiazoles (6)
Pyrazoles (5)
Triazoles (4)
Isoxazoles (1)
Oxadiazoles (1)
Oxazoles (1)

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1 – 15 of 22 results
1

1-Ethyl-3-methylimidazolium acetate, 97%, Thermo Scientific Chemicals

CAS: 143314-17-4 Molecular Formula: C8H14N2O2 Molecular Weight (g/mol): 170.212 MDL Number: MFCD06798186 InChI Key: XIYUIMLQTKODPS-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc PubChem CID: 11658353 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;acetate SMILES: CCN1C=C[N+](=C1)C.CC(=O)[O-]

PubChem CID 11658353
CAS 143314-17-4
Molecular Weight (g/mol) 170.212
MDL Number MFCD06798186
SMILES CCN1C=C[N+](=C1)C.CC(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;acetate
InChI Key XIYUIMLQTKODPS-UHFFFAOYSA-M
Molecular Formula C8H14N2O2
2

1-Ethyl-3-methylimidazolium thiocyanate, 98%, Thermo Scientific Chemicals

CAS: 331717-63-6 Molecular Formula: C7H11N3S Molecular Weight (g/mol): 169.246 MDL Number: MFCD06798182 InChI Key: VASPYXGQVWPGAB-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium thiocyanate,basionics™ vs 01,dsstox_cid_27860,dsstox_rid_82613,dsstox_gsid_47884,1-methyl-3-ethylimidazolium thiocyanate,1-ethyl-3-methyl imidazolium thio-cyanate,1-ethyl-3-methyl-1h-imidazol-3-ium thiocyanate,1-ethyl-3-methylimidazolium thiocyanate h-nmr, hplc,1-ethyl-3-methylimidazolium thiocyanate, for electrochemistry t PubChem CID: 16211115 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;thiocyanate SMILES: CCN1C=C[N+](=C1)C.C(#N)[S-]

PubChem CID 16211115
CAS 331717-63-6
Molecular Weight (g/mol) 169.246
MDL Number MFCD06798182
SMILES CCN1C=C[N+](=C1)C.C(#N)[S-]
Synonym 1-ethyl-3-methylimidazolium thiocyanate,basionics™ vs 01,dsstox_cid_27860,dsstox_rid_82613,dsstox_gsid_47884,1-methyl-3-ethylimidazolium thiocyanate,1-ethyl-3-methyl imidazolium thio-cyanate,1-ethyl-3-methyl-1h-imidazol-3-ium thiocyanate,1-ethyl-3-methylimidazolium thiocyanate h-nmr, hplc,1-ethyl-3-methylimidazolium thiocyanate, for electrochemistry t
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;thiocyanate
InChI Key VASPYXGQVWPGAB-UHFFFAOYSA-M
Molecular Formula C7H11N3S
3

1-Ethyl-3-methylimidazolium hexafluorophosphate, 98+%, Thermo Scientific Chemicals

CAS: 155371-19-0 Molecular Formula: C6H11F6N2P Molecular Weight (g/mol): 256.132 MDL Number: MFCD00216703 InChI Key: DPDAKOVGQUGTHH-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,emimpf6,dsstox_cid_27897,dsstox_rid_82650,dsstox_gsid_47921,ksc174g8p,1-ethyl-3-methylimidazol-3-ium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate,1-ethyl-3-methylimidazolium hexafluorophosphate hplc PubChem CID: 2758873 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;hexafluorophosphate SMILES: CCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F

PubChem CID 2758873
CAS 155371-19-0
Molecular Weight (g/mol) 256.132
MDL Number MFCD00216703
SMILES CCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F
Synonym 1-ethyl-3-methylimidazolium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate v,emimpf6,dsstox_cid_27897,dsstox_rid_82650,dsstox_gsid_47921,ksc174g8p,1-ethyl-3-methylimidazol-3-ium hexafluorophosphate,1-ethyl-3-methyl-1h-imidazol-3-ium hexafluorophosphate,1-ethyl-3-methylimidazolium hexafluorophosphate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;hexafluorophosphate
InChI Key DPDAKOVGQUGTHH-UHFFFAOYSA-N
Molecular Formula C6H11F6N2P
4

1-n-Hexyl-3-methylimidazolium iodide, 98%, Thermo Scientific Chemicals

CAS: 178631-05-5 Molecular Formula: C10H19IN2 Molecular Weight (g/mol): 294.18 MDL Number: MFCD12964976 InChI Key: CZIUVCSYOGFUPH-UHFFFAOYSA-M Synonym: 1-hexyl-3-methylimidazolium iodide,1-hexyl-3-methyl-1h-imidazol-3-ium iodide,1-n-hexyl-3-methylimidazolium iodide,dsstox_cid_27927,dsstox_rid_82680,dsstox_gsid_47951,1-methyl-3-hexylimidazolium iodide,1-hexyl-3-me-thylimidazolium iodide,1h-imidazolium,1-hexyl-3-methyl-,iodide,1-hexyl-3-methylimidazolium iodide hplc PubChem CID: 12036651 IUPAC Name: 1-hexyl-3-methylimidazol-3-ium;iodide SMILES: CCCCCCN1C=C[N+](=C1)C.[I-]

PubChem CID 12036651
CAS 178631-05-5
Molecular Weight (g/mol) 294.18
MDL Number MFCD12964976
SMILES CCCCCCN1C=C[N+](=C1)C.[I-]
Synonym 1-hexyl-3-methylimidazolium iodide,1-hexyl-3-methyl-1h-imidazol-3-ium iodide,1-n-hexyl-3-methylimidazolium iodide,dsstox_cid_27927,dsstox_rid_82680,dsstox_gsid_47951,1-methyl-3-hexylimidazolium iodide,1-hexyl-3-me-thylimidazolium iodide,1h-imidazolium,1-hexyl-3-methyl-,iodide,1-hexyl-3-methylimidazolium iodide hplc
IUPAC Name 1-hexyl-3-methylimidazol-3-ium;iodide
InChI Key CZIUVCSYOGFUPH-UHFFFAOYSA-M
Molecular Formula C10H19IN2
5

1-Ethyl-3-methylimidazolium methyl sulfate, 98%, Thermo Scientific Chemicals

CAS: 516474-01-4 Molecular Formula: C7H14N2O4S Molecular Weight (g/mol): 222.259 MDL Number: MFCD08457697 InChI Key: BXSDLSWVIAITRQ-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium methyl sulfate,1-ethyl-3-methylimidazolium methylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium methyl sulfate,1-ethyl-3-methylimidazolium methyl sulfate 1-,1-ethyl-3-methylimidazoliummethylsulfate,dsstox_cid_29266,dsstox_rid_83385,dsstox_gsid_49310,1-ethyl-3-methylimidazolium methylsul-fate,1-ethyl-3-methylimidazolium methyl sulfate hplc PubChem CID: 16211409 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;methyl sulfate SMILES: CCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]

PubChem CID 16211409
CAS 516474-01-4
Molecular Weight (g/mol) 222.259
MDL Number MFCD08457697
SMILES CCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium methyl sulfate,1-ethyl-3-methylimidazolium methylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium methyl sulfate,1-ethyl-3-methylimidazolium methyl sulfate 1-,1-ethyl-3-methylimidazoliummethylsulfate,dsstox_cid_29266,dsstox_rid_83385,dsstox_gsid_49310,1-ethyl-3-methylimidazolium methylsul-fate,1-ethyl-3-methylimidazolium methyl sulfate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;methyl sulfate
InChI Key BXSDLSWVIAITRQ-UHFFFAOYSA-M
Molecular Formula C7H14N2O4S
6

1-Methyl-3-n-octylimidazolium tetrafluoroborate, 99%, Thermo Scientific Chemicals

CAS: 244193-52-0 Molecular Formula: C12H23BF4N2 Molecular Weight (g/mol): 282.13 MDL Number: MFCD03095434 InChI Key: GXZCAMSPWNHTAE-UHFFFAOYSA-N Synonym: 1-methyl-3-octylimidazolium tetrafluoroborate,1-methyl-3-n-octylimidazolium tetrafluoroborate,3-methyl-1-octylimidazolium tetrafluoroborate,1-octyl-3-methylimidazolium tetrafluoroborate,omimbf4,dsstox_cid_27919,dsstox_rid_82672,dsstox_gsid_47943,3-methyl-1-octylimidazoliumtetrafluoroborate,1-methyl-3-octylimidazolium tetrafluoroborate hplc PubChem CID: 11460221 SMILES: F[B-](F)(F)F.CCCCCCCCN1C=C[N+](C)=C1

PubChem CID 11460221
CAS 244193-52-0
Molecular Weight (g/mol) 282.13
MDL Number MFCD03095434
SMILES F[B-](F)(F)F.CCCCCCCCN1C=C[N+](C)=C1
Synonym 1-methyl-3-octylimidazolium tetrafluoroborate,1-methyl-3-n-octylimidazolium tetrafluoroborate,3-methyl-1-octylimidazolium tetrafluoroborate,1-octyl-3-methylimidazolium tetrafluoroborate,omimbf4,dsstox_cid_27919,dsstox_rid_82672,dsstox_gsid_47943,3-methyl-1-octylimidazoliumtetrafluoroborate,1-methyl-3-octylimidazolium tetrafluoroborate hplc
InChI Key GXZCAMSPWNHTAE-UHFFFAOYSA-N
Molecular Formula C12H23BF4N2
7

NH 125, Tocris Bioscience™

CAS: 278603-08-0 Molecular Formula: C27H45IN2 Molecular Weight (g/mol): 524.575 InChI Key: RVWOHCBHAGBLLT-UHFFFAOYSA-M Synonym: 1-benzyl-3-cetyl-2-methylimidazolium iodide,eef-2 kinase inhibitor, nh125,1-hexadecyl-2-methyl-3-phenylmethyl-1h-imidazolium iodide,nh hplc , solid,1-benzyl-3-hexadecyl-2-methylimidazol-1-ium iodide PubChem CID: 10436839 IUPAC Name: 1-benzyl-3-hexadecyl-2-methylimidazol-1-ium;iodide SMILES: CCCCCCCCCCCCCCCCN1C=C[N+](=C1C)CC2=CC=CC=C2.[I-]

PubChem CID 10436839
CAS 278603-08-0
Molecular Weight (g/mol) 524.575
SMILES CCCCCCCCCCCCCCCCN1C=C[N+](=C1C)CC2=CC=CC=C2.[I-]
Synonym 1-benzyl-3-cetyl-2-methylimidazolium iodide,eef-2 kinase inhibitor, nh125,1-hexadecyl-2-methyl-3-phenylmethyl-1h-imidazolium iodide,nh hplc , solid,1-benzyl-3-hexadecyl-2-methylimidazol-1-ium iodide
IUPAC Name 1-benzyl-3-hexadecyl-2-methylimidazol-1-ium;iodide
InChI Key RVWOHCBHAGBLLT-UHFFFAOYSA-M
Molecular Formula C27H45IN2
8

Amthamine dihydrobromide, Tocris Bioscience™

CAS: 142457-00-9 Molecular Formula: C6H13Br2N3S Molecular Weight (g/mol): 319.059 InChI Key: XFXNNOPUDSFVJE-UHFFFAOYSA-N Synonym: amthamine dihydrobromide,5-thiazoleethanamine,2-amino-4-methyl,amthamine dihydrobromide hplc , solid,2-amino-4-methyl-5-thiazoleethanamine dihydrobromide,2-amino-5-2-aminoethyl-4-methylthiazole dihydrobromide,5-2-aminoethyl-4-methyl-1,3-thiazol-2-amine-hydrogen bromide 1/2 PubChem CID: 16218912 IUPAC Name: 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;dihydrobromide SMILES: CC1=C(SC(=N1)N)CCN.Br.Br

PubChem CID 16218912
CAS 142457-00-9
Molecular Weight (g/mol) 319.059
SMILES CC1=C(SC(=N1)N)CCN.Br.Br
Synonym amthamine dihydrobromide,5-thiazoleethanamine,2-amino-4-methyl,amthamine dihydrobromide hplc , solid,2-amino-4-methyl-5-thiazoleethanamine dihydrobromide,2-amino-5-2-aminoethyl-4-methylthiazole dihydrobromide,5-2-aminoethyl-4-methyl-1,3-thiazol-2-amine-hydrogen bromide 1/2
IUPAC Name 5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine;dihydrobromide
InChI Key XFXNNOPUDSFVJE-UHFFFAOYSA-N
Molecular Formula C6H13Br2N3S
9

Eact, Tocris Bioscience™

CAS: 461000-66-8 Molecular Formula: C22H24N2O5S Molecular Weight (g/mol): 428.503 InChI Key: ZUXNHFFVQWADJL-UHFFFAOYSA-N Synonym: eact,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenyl-1,3-thiazol-2-yl benzamide,eact hplc,3,4,5-trimethoxy-n-2-methoxy-ethyl-n-4-phenyl-thiazol-2-yl-benzamide,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenyl-2-thiazolyl benzamide,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenylthiazol-2-yl benzamide,n-4-phenylthiazole-2-yl-n-2-methoxyethyl-3,4,5-trimethoxybenzamide PubChem CID: 3173542 IUPAC Name: 3,4,5-trimethoxy-N-(2-methoxyethyl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide SMILES: COCCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

PubChem CID 3173542
CAS 461000-66-8
Molecular Weight (g/mol) 428.503
SMILES COCCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC
Synonym eact,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenyl-1,3-thiazol-2-yl benzamide,eact hplc,3,4,5-trimethoxy-n-2-methoxy-ethyl-n-4-phenyl-thiazol-2-yl-benzamide,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenyl-2-thiazolyl benzamide,3,4,5-trimethoxy-n-2-methoxyethyl-n-4-phenylthiazol-2-yl benzamide,n-4-phenylthiazole-2-yl-n-2-methoxyethyl-3,4,5-trimethoxybenzamide
IUPAC Name 3,4,5-trimethoxy-N-(2-methoxyethyl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
InChI Key ZUXNHFFVQWADJL-UHFFFAOYSA-N
Molecular Formula C22H24N2O5S
10

VER 155008, Tocris Bioscience™

CAS: 1134156-31-2 Molecular Formula: C25H23Cl2N7O4 Molecular Weight (g/mol): 556.40 MDL Number: MFCD18086892 InChI Key: ZXGGCBQORXDVTE-UHFFFAOYNA-N Synonym: 5'-o-4-cyanophenyl methyl-8-3,4-dichlorophenyl methyl amino-adenosine,5'-o-4-cyanophenyl methyl-8-3,4-dichlorophenyl-methyl amino-adenosine,4-2r,3s,4r,5r-5-6-amino-8-3,4-dichlorobenzyl amino-9h-purin-9-yl-3,4-dihydroxytetrahydrofuran-2-yl methoxy methyl benzonitrile,3fd,d0h0au,adenosine-derived inhibitor, 12,hsp 70 inhibitor cancer , vernalis,adenosine-derived inhibitor grp78 , 13,ver hplc,heat shock protein 70 inhibitor cancer , vernalis PubChem CID: 25195348 IUPAC Name: 4-({[5-(6-amino-8-{[(3,4-dichlorophenyl)methyl]amino}-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}methyl)benzonitrile SMILES: NC1=C2N=C(NCC3=CC(Cl)=C(Cl)C=C3)N(C3OC(COCC4=CC=C(C=C4)C#N)C(O)C3O)C2=NC=N1

PubChem CID 25195348
CAS 1134156-31-2
Molecular Weight (g/mol) 556.40
MDL Number MFCD18086892
SMILES NC1=C2N=C(NCC3=CC(Cl)=C(Cl)C=C3)N(C3OC(COCC4=CC=C(C=C4)C#N)C(O)C3O)C2=NC=N1
Synonym 5'-o-4-cyanophenyl methyl-8-3,4-dichlorophenyl methyl amino-adenosine,5'-o-4-cyanophenyl methyl-8-3,4-dichlorophenyl-methyl amino-adenosine,4-2r,3s,4r,5r-5-6-amino-8-3,4-dichlorobenzyl amino-9h-purin-9-yl-3,4-dihydroxytetrahydrofuran-2-yl methoxy methyl benzonitrile,3fd,d0h0au,adenosine-derived inhibitor, 12,hsp 70 inhibitor cancer , vernalis,adenosine-derived inhibitor grp78 , 13,ver hplc,heat shock protein 70 inhibitor cancer , vernalis
IUPAC Name 4-({[5-(6-amino-8-{[(3,4-dichlorophenyl)methyl]amino}-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}methyl)benzonitrile
InChI Key ZXGGCBQORXDVTE-UHFFFAOYNA-N
Molecular Formula C25H23Cl2N7O4
11

DMH-1, Tocris Bioscience™

CAS: 1206711-16-1 Molecular Formula: C24H20N4O Molecular Weight (g/mol): 380.45 MDL Number: MFCD18384963 InChI Key: JMIFGARJSWXZSH-UHFFFAOYSA-N Synonym: dmh-1,dmh1,dmh 1,4-6-4-propan-2-yloxyphenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,4-6-4-1-methylethoxy phenyl pyrazolo 1,5-a pyrimidin-3-yl-quinoline,4-6-4-isopropoxyphenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,4-6-4-propan-2-yl oxy phenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,dmh hplc,quinoline, 4-6-4-1-methylethoxy phenyl pyrazolo 1,5-a pyrimidin-3-yl PubChem CID: 50997747 ChEBI: CHEBI:86289 IUPAC Name: 4-{6-[4-(propan-2-yloxy)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl}quinoline SMILES: CC(C)OC1=CC=C(C=C1)C1=CN2N=CC(=C2N=C1)C1=C2C=CC=CC2=NC=C1

PubChem CID 50997747
CAS 1206711-16-1
Molecular Weight (g/mol) 380.45
ChEBI CHEBI:86289
MDL Number MFCD18384963
SMILES CC(C)OC1=CC=C(C=C1)C1=CN2N=CC(=C2N=C1)C1=C2C=CC=CC2=NC=C1
Synonym dmh-1,dmh1,dmh 1,4-6-4-propan-2-yloxyphenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,4-6-4-1-methylethoxy phenyl pyrazolo 1,5-a pyrimidin-3-yl-quinoline,4-6-4-isopropoxyphenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,4-6-4-propan-2-yl oxy phenyl pyrazolo 1,5-a pyrimidin-3-yl quinoline,dmh hplc,quinoline, 4-6-4-1-methylethoxy phenyl pyrazolo 1,5-a pyrimidin-3-yl
IUPAC Name 4-{6-[4-(propan-2-yloxy)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl}quinoline
InChI Key JMIFGARJSWXZSH-UHFFFAOYSA-N
Molecular Formula C24H20N4O
12

Ro 90-7501, Tocris Bioscience™

CAS: 293762-45-5 Molecular Formula: C20H16N6 Molecular Weight (g/mol): 340.39 InChI Key: PAGZCEHLFCJSPV-UHFFFAOYSA-N Synonym: gnf-pf-5510,2'-4-amino-phenyl-3h,3'h-2,5' bibenzoimidazolyl-5-ylamine,2-2-4-aminophenyl-3h-1,3-benzodiazol-5-yl-3h-1,3-benzodiazol-5-amine,cbchromo1_000149,cambridge id 5180073,ro hplc,2'-4-aminophenyl-2,5'-bi-1h-benzimidazol-5-amine,2'-4-aminophenyl-1h,1'h-2,5'-bibenzimidazol-5-amine,2,5'-bi-1h-benzimidazol-5-amine, 2'-4-aminophenyl,2-2-4-aminophenyl benzimidazol-6-yl benzimidazole-6-ylamine PubChem CID: 824226 IUPAC Name: 2-[2-(4-aminophenyl)-3H-benzimidazol-5-yl]-3H-benzimidazol-5-amine SMILES: C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N)N

PubChem CID 824226
CAS 293762-45-5
Molecular Weight (g/mol) 340.39
SMILES C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N)N
Synonym gnf-pf-5510,2'-4-amino-phenyl-3h,3'h-2,5' bibenzoimidazolyl-5-ylamine,2-2-4-aminophenyl-3h-1,3-benzodiazol-5-yl-3h-1,3-benzodiazol-5-amine,cbchromo1_000149,cambridge id 5180073,ro hplc,2'-4-aminophenyl-2,5'-bi-1h-benzimidazol-5-amine,2'-4-aminophenyl-1h,1'h-2,5'-bibenzimidazol-5-amine,2,5'-bi-1h-benzimidazol-5-amine, 2'-4-aminophenyl,2-2-4-aminophenyl benzimidazol-6-yl benzimidazole-6-ylamine
IUPAC Name 2-[2-(4-aminophenyl)-3H-benzimidazol-5-yl]-3H-benzimidazol-5-amine
InChI Key PAGZCEHLFCJSPV-UHFFFAOYSA-N
Molecular Formula C20H16N6
13

CGP 57380, Tocris Bioscience™

CAS: 522629-08-9 Molecular Formula: C11H9FN6 Molecular Weight (g/mol): 244.233 InChI Key: UQPMANVRZYYQMD-UHFFFAOYSA-N Synonym: mnk1 inhibitor,n3-4-fluorophenyl-1h-pyrazolo 3,4-d pyrimidine-3,4-diamine,4-amino-5-4-fluoroanilino-pyrazolo 3,4-d pyrimidine,d0a7fq,cgp hplc,n-4-fluorophenyl-3h-pyrazolo 3,4-d pyrimidine-3,4-diamine,3-n-4-fluorophenyl-1h-pyrazolo 3,4-d pyrimidine-3,4-diamine,3-n-4-fluorophenyl-2h-pyrazolo 3,4-d pyrimidine-3,4-diamine,n3-4-fluorophenyl-1h-pyrazolo-3,4-d pyrimidine-3,4-diamine,n3-4-fluorophenyl-2h-pyrazolo 3,4-d pyrimidine-3,4-diamine PubChem CID: 11644425 IUPAC Name: 3-N-(4-fluorophenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine SMILES: C1=CC(=CC=C1NC2=C3C(=NC=NC3=NN2)N)F

PubChem CID 11644425
CAS 522629-08-9
Molecular Weight (g/mol) 244.233
SMILES C1=CC(=CC=C1NC2=C3C(=NC=NC3=NN2)N)F
Synonym mnk1 inhibitor,n3-4-fluorophenyl-1h-pyrazolo 3,4-d pyrimidine-3,4-diamine,4-amino-5-4-fluoroanilino-pyrazolo 3,4-d pyrimidine,d0a7fq,cgp hplc,n-4-fluorophenyl-3h-pyrazolo 3,4-d pyrimidine-3,4-diamine,3-n-4-fluorophenyl-1h-pyrazolo 3,4-d pyrimidine-3,4-diamine,3-n-4-fluorophenyl-2h-pyrazolo 3,4-d pyrimidine-3,4-diamine,n3-4-fluorophenyl-1h-pyrazolo-3,4-d pyrimidine-3,4-diamine,n3-4-fluorophenyl-2h-pyrazolo 3,4-d pyrimidine-3,4-diamine
IUPAC Name 3-N-(4-fluorophenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine
InChI Key UQPMANVRZYYQMD-UHFFFAOYSA-N
Molecular Formula C11H9FN6
14

GW 583340 dihydrochloride, Tocris Bioscience™

CAS: 1173023-85-2 Molecular Formula: C28H27Cl3FN5O3S2 Molecular Weight (g/mol): 671.024 InChI Key: WIMITXDBYLKRKB-UHFFFAOYSA-N Synonym: gw583340 dihydrochloride,gw 583340 dihydrochloride,n-3-chloro-4-3-fluorophenyl methoxy phenyl-6-2-2-methanesulfonylethyl amino methyl-1,3-thiazol-4-yl quinazolin-4-amine dihydrochloride,d0hp5b,gw583340 dihydrochloride hplc , solid,4-3-chloro-4-3-fluorophenyl methoxy phenylamino-6-2-2-methylsulfonyl ethyl aminomethyl-4-thiazolyl quinazoline dihydrochloride,n-3-chloro-4-3-fluorobenzyloxy phenyl-6-2-2-methylsulfonyl ethylamino methyl thiazol-4-yl quinazolin-4-amine dihydrochloride,n-3-chloro-4-3-fluorophenyl methoxy phenyl-6-2-2-methylsulfonyl ethyl amino methyl-4-thiazolyl-4-quinazolinamine dihydrochloride PubChem CID: 16219404 IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-4-yl]quinazolin-4-amine;dihydrochloride SMILES: CS(=O)(=O)CCNCC1=NC(=CS1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl.Cl.Cl

PubChem CID 16219404
CAS 1173023-85-2
Molecular Weight (g/mol) 671.024
SMILES CS(=O)(=O)CCNCC1=NC(=CS1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl.Cl.Cl
Synonym gw583340 dihydrochloride,gw 583340 dihydrochloride,n-3-chloro-4-3-fluorophenyl methoxy phenyl-6-2-2-methanesulfonylethyl amino methyl-1,3-thiazol-4-yl quinazolin-4-amine dihydrochloride,d0hp5b,gw583340 dihydrochloride hplc , solid,4-3-chloro-4-3-fluorophenyl methoxy phenylamino-6-2-2-methylsulfonyl ethyl aminomethyl-4-thiazolyl quinazoline dihydrochloride,n-3-chloro-4-3-fluorobenzyloxy phenyl-6-2-2-methylsulfonyl ethylamino methyl thiazol-4-yl quinazolin-4-amine dihydrochloride,n-3-chloro-4-3-fluorophenyl methoxy phenyl-6-2-2-methylsulfonyl ethyl amino methyl-4-thiazolyl-4-quinazolinamine dihydrochloride
IUPAC Name N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-4-yl]quinazolin-4-amine;dihydrochloride
InChI Key WIMITXDBYLKRKB-UHFFFAOYSA-N
Molecular Formula C28H27Cl3FN5O3S2
15

L-655,708, Tocris Bioscience™

CAS: 130477-52-0 Molecular Formula: C18H19N3O4 Molecular Weight (g/mol): 341.367 InChI Key: YKYOQIXTECBVBB-AWEZNQCLSA-N Synonym: chembl52030,ethyl s-11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrrolo 2,1-c 1,4 benzodiazepine-1-carboxylate,l hplc , powder,s-9-methoxy-7-oxo-3b,4,5,6-tetrahydro-7h-2,6a,11b-triaza-benzo g cyclopenta e azulene-3-carboxylic acid ethyl ester,11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrrolo 2,1-c 1,4 benzodiazepine-1-carboxylic acid, ethyl ester,9-methoxy-7-oxo-3b,4,5,6-tetrahydro-7h-2,6a,11b-triaza-benzo g cyclopenta e azulene-3-carboxylic acid ethyl ester msd,ethyl 7s-15-methoxy-12-oxo-2,4,11-triazatetracyclo 11.4.0.0 2 ,?.0?, 1 1 heptadeca-1 17 ,3,5,13,15-pentaene-5-carboxylate,ethyl s-11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrro-lo 2,1-c 1,4-benzodiazepine-1-carboxylate PubChem CID: 5311203 SMILES: CCOC(=O)C1=C2C3CCCN3C(=O)C4=C(N2C=N1)C=CC(=C4)OC

PubChem CID 5311203
CAS 130477-52-0
Molecular Weight (g/mol) 341.367
SMILES CCOC(=O)C1=C2C3CCCN3C(=O)C4=C(N2C=N1)C=CC(=C4)OC
Synonym chembl52030,ethyl s-11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrrolo 2,1-c 1,4 benzodiazepine-1-carboxylate,l hplc , powder,s-9-methoxy-7-oxo-3b,4,5,6-tetrahydro-7h-2,6a,11b-triaza-benzo g cyclopenta e azulene-3-carboxylic acid ethyl ester,11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrrolo 2,1-c 1,4 benzodiazepine-1-carboxylic acid, ethyl ester,9-methoxy-7-oxo-3b,4,5,6-tetrahydro-7h-2,6a,11b-triaza-benzo g cyclopenta e azulene-3-carboxylic acid ethyl ester msd,ethyl 7s-15-methoxy-12-oxo-2,4,11-triazatetracyclo 11.4.0.0 2 ,?.0?, 1 1 heptadeca-1 17 ,3,5,13,15-pentaene-5-carboxylate,ethyl s-11,12,13,13a-tetrahydro-7-methoxy-9-oxo-9h-imidazo 1,5-a pyrro-lo 2,1-c 1,4-benzodiazepine-1-carboxylate
InChI Key YKYOQIXTECBVBB-AWEZNQCLSA-N
Molecular Formula C18H19N3O4