Friday, April 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (3S)-N-(4-cyanophenyl)-1-isopropyl-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3S)-N-(4-cyanophenyl)-5-oxo-1-propan-2-yl-3-pyrrolidinecarboxamide
IUPAC NAME: (3S)-N-(4-cyanophenyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3S)-N-(4-cyanophenyl)-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C15H17N3O2
MOLECULAR WEIGHT: 271.31438
SMILES: CC(C)N1C[C@H](CC1=O)C(=O)NC2=CC=C(C=C2)C#N
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Product OPENEYE NAME: (3R)-N-(4-cyanophenyl)-1-isopropyl-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3R)-N-(4-cyanophenyl)-5-oxo-1-propan-2-yl-3-pyrrolidinecarboxamide
IUPAC NAME: (3R)-N-(4-cyanophenyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3R)-N-(4-cyanophenyl)-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C15H17N3O2
MOLECULAR WEIGHT: 271.31438
SMILES: CC(C)N1C[C@@H](CC1=O)C(=O)NC2=CC=C(C=C2)C#N
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Product OPENEYE NAME: N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thiophene-2-carboxamide
CAS Name: N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-thiophenecarboxamide
IUPAC NAME: N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thiophene-2-carboxamide
SYSTEMATIC NAME: N-(5-methyl-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thiophene-2-carboxamide
MOLECULAR FORMULA: C11H9N5O2S
MOLECULAR WEIGHT: 275.28646
SMILES: CC1=CC(=O)N2C(=N1)N=C(N2)NC(=O)C3=CC=CS3
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Product OPENEYE NAME: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid
CAS Name: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
IUPAC NAME: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[(3R)-3-(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H23N3O4
MOLECULAR WEIGHT: 417.45712
SMILES: CC1=CC=C(C=C1)C2=NN([C@H](C2)C3=CC4=C(C(=CC=C4)C)NC3=O)C(=O)CCC(=O)O
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Product OPENEYE NAME: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid
CAS Name: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
IUPAC NAME: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[(3S)-3-(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H23N3O4
MOLECULAR WEIGHT: 417.45712
SMILES: CC1=CC=C(C=C1)C2=NN([C@@H](C2)C3=CC4=C(C(=CC=C4)C)NC3=O)C(=O)CCC(=O)O
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Product OPENEYE NAME: 4-oxo-4-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
CAS Name: 4-oxo-4-[(3R)-5-phenyl-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]butanoic acid
IUPAC NAME: 4-oxo-4-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
SYSTEMATIC NAME: 4-oxidanylidene-4-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
MOLECULAR FORMULA: C21H18N4O3
MOLECULAR WEIGHT: 374.39262
SMILES: C1[C@@H](N(N=C1C2=CC=CC=C2)C(=O)CCC(=O)O)C3=CC4=NC=CN=C4C=C3
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Product OPENEYE NAME: 4-oxo-4-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
CAS Name: 4-oxo-4-[(3S)-5-phenyl-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]butanoic acid
IUPAC NAME: 4-oxo-4-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
SYSTEMATIC NAME: 4-oxidanylidene-4-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]butanoic acid
MOLECULAR FORMULA: C21H18N4O3
MOLECULAR WEIGHT: 374.39262
SMILES: C1[C@H](N(N=C1C2=CC=CC=C2)C(=O)CCC(=O)O)C3=CC4=NC=CN=C4C=C3
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Product OPENEYE NAME: 5-oxo-5-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
CAS Name: 5-oxo-5-[(3R)-5-phenyl-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]pentanoic acid
IUPAC NAME: 5-oxo-5-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
SYSTEMATIC NAME: 5-oxidanylidene-5-[(3R)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
MOLECULAR FORMULA: C22H20N4O3
MOLECULAR WEIGHT: 388.4192
SMILES: C1[C@@H](N(N=C1C2=CC=CC=C2)C(=O)CCCC(=O)O)C3=CC4=NC=CN=C4C=C3
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Product OPENEYE NAME: 5-oxo-5-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
CAS Name: 5-oxo-5-[(3S)-5-phenyl-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]pentanoic acid
IUPAC NAME: 5-oxo-5-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
SYSTEMATIC NAME: 5-oxidanylidene-5-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]pentanoic acid
MOLECULAR FORMULA: C22H20N4O3
MOLECULAR WEIGHT: 388.4192
SMILES: C1[C@H](N(N=C1C2=CC=CC=C2)C(=O)CCCC(=O)O)C3=CC4=NC=CN=C4C=C3
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Product OPENEYE NAME: (3R)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
CAS Name: (3R)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
IUPAC NAME: (3R)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
SYSTEMATIC NAME: (3R)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
MOLECULAR FORMULA: C20H24N2O6S
MOLECULAR WEIGHT: 420.47936
SMILES: COC1=C(C=C(C=C1)C2=NN([C@H](C2)C3=C(C(=CC=C3)OC)OC)S(=O)(=O)C)OC
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Product OPENEYE NAME: (3S)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
CAS Name: (3S)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
IUPAC NAME: (3S)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
SYSTEMATIC NAME: (3S)-3-(2,3-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
MOLECULAR FORMULA: C20H24N2O6S
MOLECULAR WEIGHT: 420.47936
SMILES: COC1=C(C=C(C=C1)C2=NN([C@@H](C2)C3=C(C(=CC=C3)OC)OC)S(=O)(=O)C)OC
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Product OPENEYE NAME: 2-(4-benzyl-1-piperidyl)-4,6-dimethoxy-1,3,5-triazine
CAS Name: 2,4-dimethoxy-6-[4-(phenylmethyl)-1-piperidinyl]-1,3,5-triazine
IUPAC NAME: 2-(4-benzylpiperidin-1-yl)-4,6-dimethoxy-1,3,5-triazine
SYSTEMATIC NAME: 2,4-dimethoxy-6-[4-(phenylmethyl)piperidin-1-yl]-1,3,5-triazine
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: COC1=NC(=NC(=N1)N2CCC(CC2)CC3=CC=CC=C3)OC
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Product OPENEYE NAME: N-(3-chloro-4-methoxy-phenyl)-4,6-diethoxy-1,3,5-triazin-2-amine
CAS Name: N-(3-chloro-4-methoxyphenyl)-4,6-diethoxy-1,3,5-triazin-2-amine
IUPAC NAME: N-(3-chloro-4-methoxyphenyl)-4,6-diethoxy-1,3,5-triazin-2-amine
SYSTEMATIC NAME: N-(3-chloranyl-4-methoxy-phenyl)-4,6-diethoxy-1,3,5-triazin-2-amine
MOLECULAR FORMULA: C14H17ClN4O3
MOLECULAR WEIGHT: 324.76278
SMILES: CCOC1=NC(=NC(=N1)NC2=CC(=C(C=C2)OC)Cl)OCC
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