Pyrimidines And Derivatives

Pyrimidines And Derivatives
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Thermo Scientific Chemicals Thiamine hydrochloride, 98.5-101.5%
CAS: 67-03-8 Molecular Formula: C12H17ClN4OS·HCl Molecular Weight (g/mol): 337.26 MDL Number: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Synonym: thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride PubChem CID: 6202 ChEBI: CHEBI:49105 IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
PubChem CID | 6202 |
---|---|
CAS | 67-03-8 |
Molecular Weight (g/mol) | 337.26 |
ChEBI | CHEBI:49105 |
MDL Number | MFCD00012780 |
SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-] |
Synonym | thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride |
IUPAC Name | 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride |
InChI Key | DPJRMOMPQZCRJU-UHFFFAOYSA-M |
Molecular Formula | C12H17ClN4OS·HCl |
Thermo Scientific Chemicals Uracil, 99+%
CAS: 66-22-8 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006016 InChI Key: ISAKRJDGNUQOIC-UHFFFAOYSA-N Synonym: uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x PubChem CID: 1174 ChEBI: CHEBI:17568 IUPAC Name: 1H-pyrimidine-2,4-dione SMILES: O=C1NC=CC(=O)N1
PubChem CID | 1174 |
---|---|
CAS | 66-22-8 |
Molecular Weight (g/mol) | 112.09 |
ChEBI | CHEBI:17568 |
MDL Number | MFCD00006016 |
SMILES | O=C1NC=CC(=O)N1 |
Synonym | uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x |
IUPAC Name | 1H-pyrimidine-2,4-dione |
InChI Key | ISAKRJDGNUQOIC-UHFFFAOYSA-N |
Molecular Formula | C4H4N2O2 |
Orotic acid, 98%, anhydrous, Thermo Scientific Chemicals
CAS: 65-86-1 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.1 InChI Key: PXQPEWDEAKTCGB-UHFFFAOYSA-N Synonym: orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor PubChem CID: 967 ChEBI: CHEBI:16742 IUPAC Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid SMILES: C1=C(NC(=O)NC1=O)C(=O)O
PubChem CID | 967 |
---|---|
CAS | 65-86-1 |
Molecular Weight (g/mol) | 156.1 |
ChEBI | CHEBI:16742 |
SMILES | C1=C(NC(=O)NC1=O)C(=O)O |
Synonym | orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor |
IUPAC Name | 2,4-dioxo-1H-pyrimidine-6-carboxylic acid |
InChI Key | PXQPEWDEAKTCGB-UHFFFAOYSA-N |
Molecular Formula | C5H4N2O4 |
Thiamine hydrochloride, 99% (dry wt.), may cont. up to 5% water, Thermo Scientific Chemicals
CAS: 67-03-8 Molecular Formula: C12H18Cl2N4OS Molecular Weight (g/mol): 337.263 MDL Number: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Synonym: thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride PubChem CID: 6202 ChEBI: CHEBI:49105 IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
PubChem CID | 6202 |
---|---|
CAS | 67-03-8 |
Molecular Weight (g/mol) | 337.263 |
ChEBI | CHEBI:49105 |
MDL Number | MFCD00012780 |
SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-] |
Synonym | thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride |
IUPAC Name | 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride |
InChI Key | DPJRMOMPQZCRJU-UHFFFAOYSA-M |
Molecular Formula | C12H18Cl2N4OS |
Thermo Scientific Chemicals 5-Fluorouracil, 99%
CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N Synonym: 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton PubChem CID: 3385 ChEBI: CHEBI:46345 IUPAC Name: 5-fluoro-1H-pyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O
PubChem CID | 3385 |
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CAS | 51-21-8 |
Molecular Weight (g/mol) | 130.08 |
ChEBI | CHEBI:46345 |
MDL Number | MFCD00006018 |
SMILES | FC1=CNC(=O)NC1=O |
Synonym | 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton |
IUPAC Name | 5-fluoro-1H-pyrimidine-2,4-dione |
InChI Key | GHASVSINZRGABV-UHFFFAOYSA-N |
Molecular Formula | C4H3FN2O2 |
Thymine, 99%, Thermo Scientific Chemicals
CAS: 65-71-4 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00006026 InChI Key: RWQNBRDOKXIBIV-UHFFFAOYSA-N Synonym: thymine,5-methyluracil,thymin,2,4-dihydroxy-5-methylpyrimidine,thymine anhydrate,2,4 1h,3h-pyrimidinedione, 5-methyl,5-methylpyrimidine-2,4 1h,3h-dione,5-methyl-2,4 1h,3h-pyrimidinedione,thymin purine base,5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione PubChem CID: 1135 ChEBI: CHEBI:17821 IUPAC Name: 5-methyl-1H-pyrimidine-2,4-dione SMILES: CC1=CNC(=O)NC1=O
PubChem CID | 1135 |
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CAS | 65-71-4 |
Molecular Weight (g/mol) | 126.11 |
ChEBI | CHEBI:17821 |
MDL Number | MFCD00006026 |
SMILES | CC1=CNC(=O)NC1=O |
Synonym | thymine,5-methyluracil,thymin,2,4-dihydroxy-5-methylpyrimidine,thymine anhydrate,2,4 1h,3h-pyrimidinedione, 5-methyl,5-methylpyrimidine-2,4 1h,3h-dione,5-methyl-2,4 1h,3h-pyrimidinedione,thymin purine base,5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione |
IUPAC Name | 5-methyl-1H-pyrimidine-2,4-dione |
InChI Key | RWQNBRDOKXIBIV-UHFFFAOYSA-N |
Molecular Formula | C5H6N2O2 |
5-Fluorocytosine, 98+%, Thermo Scientific Chemicals
CAS: 2022-85-7 Molecular Formula: C4H4FN3O Molecular Weight (g/mol): 129.09 MDL Number: MFCD00006035,MFCD00179326,MFCD03547958 InChI Key: XRECTZIEBJDKEO-UHFFFAOYSA-N Synonym: 5-fluorocytosine,flucytosine,ancotil,ancobon,flucytosin,5-fluorocystosine,fluocytosine,5-fc,5-fluorocytosin,fluorcytosine PubChem CID: 3366 ChEBI: CHEBI:5100 SMILES: NC1=C(F)C=NC(=O)N1
PubChem CID | 3366 |
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CAS | 2022-85-7 |
Molecular Weight (g/mol) | 129.09 |
ChEBI | CHEBI:5100 |
MDL Number | MFCD00006035,MFCD00179326,MFCD03547958 |
SMILES | NC1=C(F)C=NC(=O)N1 |
Synonym | 5-fluorocytosine,flucytosine,ancotil,ancobon,flucytosin,5-fluorocystosine,fluocytosine,5-fc,5-fluorocytosin,fluorcytosine |
InChI Key | XRECTZIEBJDKEO-UHFFFAOYSA-N |
Molecular Formula | C4H4FN3O |
Thermo Scientific Chemicals Uracil, 99+%
CAS: 66-22-8 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006016 InChI Key: ISAKRJDGNUQOIC-UHFFFAOYSA-N Synonym: uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x PubChem CID: 1174 ChEBI: CHEBI:17568 IUPAC Name: 1H-pyrimidine-2,4-dione SMILES: O=C1NC=CC(=O)N1
PubChem CID | 1174 |
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CAS | 66-22-8 |
Molecular Weight (g/mol) | 112.09 |
ChEBI | CHEBI:17568 |
MDL Number | MFCD00006016 |
SMILES | O=C1NC=CC(=O)N1 |
Synonym | uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x |
IUPAC Name | 1H-pyrimidine-2,4-dione |
InChI Key | ISAKRJDGNUQOIC-UHFFFAOYSA-N |
Molecular Formula | C4H4N2O2 |
4-chloro-7-methylthieno[3,2-d]pyrimidine, 97%, Thermo Scientific™
CAS: 175137-21-0 Molecular Formula: C7H5ClN2S Molecular Weight (g/mol): 184.64 MDL Number: MFCD00205202 InChI Key: IYJDOVYAFDVIDB-UHFFFAOYSA-N PubChem CID: 2777586 IUPAC Name: 4-chloro-7-methylthieno[3,2-d]pyrimidine SMILES: CC1=CSC2=C(Cl)N=CN=C12
PubChem CID | 2777586 |
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CAS | 175137-21-0 |
Molecular Weight (g/mol) | 184.64 |
MDL Number | MFCD00205202 |
SMILES | CC1=CSC2=C(Cl)N=CN=C12 |
IUPAC Name | 4-chloro-7-methylthieno[3,2-d]pyrimidine |
InChI Key | IYJDOVYAFDVIDB-UHFFFAOYSA-N |
Molecular Formula | C7H5ClN2S |
5-Fluorouracil, 99%, Thermo Scientific Chemicals
CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N Synonym: 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton PubChem CID: 3385 ChEBI: CHEBI:46345 IUPAC Name: 5-fluoro-1H-pyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O
PubChem CID | 3385 |
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CAS | 51-21-8 |
Molecular Weight (g/mol) | 130.08 |
ChEBI | CHEBI:46345 |
MDL Number | MFCD00006018 |
SMILES | FC1=CNC(=O)NC1=O |
Synonym | 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton |
IUPAC Name | 5-fluoro-1H-pyrimidine-2,4-dione |
InChI Key | GHASVSINZRGABV-UHFFFAOYSA-N |
Molecular Formula | C4H3FN2O2 |
6-Bromopyrazolo[1,5-a]pyrimidine, 97%, Thermo Scientific Chemicals
CAS: 705263-10-1 Molecular Formula: C6H4BrN3 Molecular Weight (g/mol): 198.02 MDL Number: MFCD09832894 InChI Key: VDHTXLUCUNPVLO-UHFFFAOYSA-N Synonym: 6-bromopyrazolo 1,5-a pyrimidine,6-bromo-pyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine, 6-bromo,pubchem15248,acmc-209of0 PubChem CID: 22236701 IUPAC Name: 6-bromopyrazolo[1,5-a]pyrimidine SMILES: BrC1=CN2N=CC=C2N=C1
PubChem CID | 22236701 |
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CAS | 705263-10-1 |
Molecular Weight (g/mol) | 198.02 |
MDL Number | MFCD09832894 |
SMILES | BrC1=CN2N=CC=C2N=C1 |
Synonym | 6-bromopyrazolo 1,5-a pyrimidine,6-bromo-pyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine, 6-bromo,pubchem15248,acmc-209of0 |
IUPAC Name | 6-bromopyrazolo[1,5-a]pyrimidine |
InChI Key | VDHTXLUCUNPVLO-UHFFFAOYSA-N |
Molecular Formula | C6H4BrN3 |
Orotic acid, anhydrous, 97%, Thermo Scientific Chemicals
CAS: 65-86-1 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.097 MDL Number: MFCD00006027 InChI Key: PXQPEWDEAKTCGB-UHFFFAOYSA-N Synonym: orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor PubChem CID: 967 ChEBI: CHEBI:16742 IUPAC Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid SMILES: C1=C(NC(=O)NC1=O)C(=O)O
PubChem CID | 967 |
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CAS | 65-86-1 |
Molecular Weight (g/mol) | 156.097 |
ChEBI | CHEBI:16742 |
MDL Number | MFCD00006027 |
SMILES | C1=C(NC(=O)NC1=O)C(=O)O |
Synonym | orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor |
IUPAC Name | 2,4-dioxo-1H-pyrimidine-6-carboxylic acid |
InChI Key | PXQPEWDEAKTCGB-UHFFFAOYSA-N |
Molecular Formula | C5H4N2O4 |
4,6-Dihydroxy-2-mercaptopyrimidine, 98%, Thermo Scientific Chemicals
CAS: 504-17-6 Molecular Formula: C4H4N2O2S Molecular Weight (g/mol): 144.15 MDL Number: MFCD00006674 InChI Key: RVBUGGBMJDPOST-UHFFFAOYSA-N Synonym: 2-thiobarbituric acid,thiobarbituric acid,bathyran,austranal,4,6-dihydroxy-2-thiopyrimidine,2-thioxodihydropyrimidine-4,6 1h,5h-dione,2-thio-4,6-dioxypyrimidine,usaf ek-660,4,6 1h,5h-pyrimidinedione, dihydro-2-thioxo,2-mercaptobarbituric acid PubChem CID: 2723628 ChEBI: CHEBI:33202 IUPAC Name: 2-sulfanylidene-1,3-diazinane-4,6-dione SMILES: O=C1CC(=O)NC(=S)N1
PubChem CID | 2723628 |
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CAS | 504-17-6 |
Molecular Weight (g/mol) | 144.15 |
ChEBI | CHEBI:33202 |
MDL Number | MFCD00006674 |
SMILES | O=C1CC(=O)NC(=S)N1 |
Synonym | 2-thiobarbituric acid,thiobarbituric acid,bathyran,austranal,4,6-dihydroxy-2-thiopyrimidine,2-thioxodihydropyrimidine-4,6 1h,5h-dione,2-thio-4,6-dioxypyrimidine,usaf ek-660,4,6 1h,5h-pyrimidinedione, dihydro-2-thioxo,2-mercaptobarbituric acid |
IUPAC Name | 2-sulfanylidene-1,3-diazinane-4,6-dione |
InChI Key | RVBUGGBMJDPOST-UHFFFAOYSA-N |
Molecular Formula | C4H4N2O2S |
Barbituric acid, 99%, Thermo Scientific Chemicals
CAS: 67-52-7 Molecular Formula: C4H4N2O3 Molecular Weight (g/mol): 128.09 MDL Number: MFCD00006666 InChI Key: HNYOPLTXPVRDBG-UHFFFAOYSA-N Synonym: barbituric acid,malonylurea,2,4,6 1h,3h,5h-pyrimidinetrione,6-hydroxyuracil,pyrimidinetrione,2,4,6-trihydroxypyrimidine,2,4,6-pyrimidinetrione,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,malonylharnstoff PubChem CID: 6211 ChEBI: CHEBI:16294 IUPAC Name: 1,3-diazinane-2,4,6-trione SMILES: O=C1CC(=O)NC(=O)N1
PubChem CID | 6211 |
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CAS | 67-52-7 |
Molecular Weight (g/mol) | 128.09 |
ChEBI | CHEBI:16294 |
MDL Number | MFCD00006666 |
SMILES | O=C1CC(=O)NC(=O)N1 |
Synonym | barbituric acid,malonylurea,2,4,6 1h,3h,5h-pyrimidinetrione,6-hydroxyuracil,pyrimidinetrione,2,4,6-trihydroxypyrimidine,2,4,6-pyrimidinetrione,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,malonylharnstoff |
IUPAC Name | 1,3-diazinane-2,4,6-trione |
InChI Key | HNYOPLTXPVRDBG-UHFFFAOYSA-N |
Molecular Formula | C4H4N2O3 |
Pyrimethamine, 98%, Thermo Scientific Chemicals
CAS: 58-14-0 Molecular Formula: C12H13ClN4 Molecular Weight (g/mol): 248.71 MDL Number: MFCD00057350 InChI Key: WKSAUQYGYAYLPV-UHFFFAOYSA-N Synonym: pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide PubChem CID: 4993 ChEBI: CHEBI:8673 IUPAC Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine SMILES: CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1
PubChem CID | 4993 |
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CAS | 58-14-0 |
Molecular Weight (g/mol) | 248.71 |
ChEBI | CHEBI:8673 |
MDL Number | MFCD00057350 |
SMILES | CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1 |
Synonym | pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide |
IUPAC Name | 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine |
InChI Key | WKSAUQYGYAYLPV-UHFFFAOYSA-N |
Molecular Formula | C12H13ClN4 |