Thursday, January 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-4-oxo-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-4-oxo-2-(phenacylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-4-oxo-2-phenacylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-4-oxidanylidene-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C28H28N2O6S2
MOLECULAR WEIGHT: 552.66172
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CC(=C(C=C3)OC)OC)SCC(=O)C4=CC=CC=C4)C
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Product OPENEYE NAME: ethyl 2-[2-(butylamino)-2-oxo-ethyl]sulfanyl-3-[(3-chlorophenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 2-[[2-(butylamino)-2-oxoethyl]thio]-3-[(3-chlorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[2-(butylamino)-2-oxoethyl]sulfanyl-3-[(3-chlorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[2-(butylamino)-2-oxidanylidene-ethyl]sulfanyl-3-[(3-chlorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C23H26ClN3O4S2
MOLECULAR WEIGHT: 508.05324
SMILES: CCCCNC(=O)CSC1=NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N1CC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: ethyl 2-[2-[benzyl(methyl)amino]-2-oxo-ethyl]sulfanyl-5-methyl-4-oxo-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 5-methyl-2-[[2-[methyl-(phenylmethyl)amino]-2-oxoethyl]thio]-4-oxo-3-(2-phenylethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[2-[benzyl(methyl)amino]-2-oxoethyl]sulfanyl-5-methyl-4-oxo-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 5-methyl-2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C28H29N3O4S2
MOLECULAR WEIGHT: 535.67756
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)N(C)CC4=CC=CC=C4)C
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Product OPENEYE NAME: ethyl 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-3-[2-(1-cyclohexenyl)ethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[2-(cyclohexen-1-yl)ethyl]-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C28H32N2O5S2
MOLECULAR WEIGHT: 540.69408
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CCCCC3)SCC4=C(C=CC(=C4)C(=O)C)OC)C
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Product OPENEYE NAME: ethyl 3-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]thio]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]sulfanyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C27H24ClN3O6S2
MOLECULAR WEIGHT: 586.07896
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC4=C(C=C3)OCO4)SCC(=O)NCC5=CC=CC=C5Cl)C
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Product OPENEYE NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C29H29N3O5S2
MOLECULAR WEIGHT: 563.68766
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=CC=C3OC)SCC(=O)N4CCCC5=CC=CC=C54)C
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Product OPENEYE NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C29H29N3O5S2
MOLECULAR WEIGHT: 563.68766
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)OC)SCC(=O)N4CCCC5=CC=CC=C54)C
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Product OPENEYE NAME: ethyl 3-[(2-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[(2-chlorophenyl)methyl]-2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[(2-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[(2-chlorophenyl)methyl]-2-[2-[[4-(dimethylamino)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C27H27ClN4O4S2
MOLECULAR WEIGHT: 571.11068
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=CC=C3Cl)SCC(=O)NC4=CC=C(C=C4)N(C)C)C
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Product OPENEYE NAME: ethyl 3-[(4-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[(4-chlorophenyl)methyl]-2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[(4-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[(4-chlorophenyl)methyl]-2-[2-[[4-(dimethylamino)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C27H27ClN4O4S2
MOLECULAR WEIGHT: 571.11068
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=C(C=C4)N(C)C)C
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Product OPENEYE NAME: ethyl 3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-2-(phenacylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-2-phenacylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[(2-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C26H24N2O5S2
MOLECULAR WEIGHT: 508.60916
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=CC=C3OC)SCC(=O)C4=CC=CC=C4)C
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Product OPENEYE NAME: ethyl 3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-2-(phenacylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-2-phenacylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-2-phenacylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C26H24N2O5S2
MOLECULAR WEIGHT: 508.60916
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)OC)SCC(=O)C4=CC=CC=C4)C
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Product OPENEYE NAME: ethyl 3-[2-(cyclohexen-1-yl)ethyl]-5-methyl-4-oxo-2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-5-methyl-4-oxo-2-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]thio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[2-(cyclohexen-1-yl)ethyl]-5-methyl-4-oxo-2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanylthieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[2-(cyclohexen-1-yl)ethyl]-5-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C27H28F3N3O4S2
MOLECULAR WEIGHT: 579.65413
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CCCCC3)SCC(=O)NC4=CC=CC(=C4)C(F)(F)F)C
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Product OPENEYE NAME: ethyl 3-[(3-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name: 3-[(3-chlorophenyl)methyl]-2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[(3-chlorophenyl)methyl]-2-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 3-[(3-chlorophenyl)methyl]-2-[2-[[4-(dimethylamino)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C27H27ClN4O4S2
MOLECULAR WEIGHT: 571.11068
SMILES: CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC(=CC=C3)Cl)SCC(=O)NC4=CC=C(C=C4)N(C)C)C
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Product OPENEYE NAME: 5-pyrazin-2-yl-2-(2-pyridyl)-4-(4-pyridyl)pyrimidine
CAS Name: 5-(2-pyrazinyl)-2-(2-pyridinyl)-4-pyridin-4-ylpyrimidine
IUPAC NAME: 5-pyrazin-2-yl-2-pyridin-2-yl-4-pyridin-4-ylpyrimidine
SYSTEMATIC NAME: 5-pyrazin-2-yl-2-pyridin-2-yl-4-pyridin-4-yl-pyrimidine
MOLECULAR FORMULA: C18H12N6
MOLECULAR WEIGHT: 312.32808
SMILES: C1=CC=NC(=C1)C2=NC=C(C(=N2)C3=CC=NC=C3)C4=NC=CN=C4
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Product OPENEYE NAME: N-[2-[2-[(1-acetyl-4-piperidyl)-cyclopropyl-amino]-2-oxo-ethyl]sulfanylethyl]benzamide
CAS Name: N-[2-[[2-[(1-acetyl-4-piperidinyl)-cyclopropylamino]-2-oxoethyl]thio]ethyl]benzamide
IUPAC NAME: N-[2-[2-[(1-acetylpiperidin-4-yl)-cyclopropylamino]-2-oxoethyl]sulfanylethyl]benzamide
SYSTEMATIC NAME: N-[2-[2-[cyclopropyl-(1-ethanoylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]sulfanylethyl]benzamide
MOLECULAR FORMULA: C21H29N3O3S
MOLECULAR WEIGHT: 403.53826
SMILES: CC(=O)N1CCC(CC1)N(C2CC2)C(=O)CSCCNC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: N-methyl-N-(o-tolyl)-1-oxo-isochromene-4-carboxamide
CAS Name: N-methyl-N-(2-methylphenyl)-1-oxo-2-benzopyran-4-carboxamide
IUPAC NAME: N-methyl-N-(2-methylphenyl)-1-oxoisochromene-4-carboxamide
SYSTEMATIC NAME: N-methyl-N-(2-methylphenyl)-1-oxidanylidene-isochromene-4-carboxamide
MOLECULAR FORMULA: C18H15NO3
MOLECULAR WEIGHT: 293.3166
SMILES: CC1=CC=CC=C1N(C)C(=O)C2=COC(=O)C3=CC=CC=C32
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-N-ethyl-1-oxo-isochromene-4-carboxamide
CAS Name: N-(3,4-dimethylphenyl)-N-ethyl-1-oxo-2-benzopyran-4-carboxamide
IUPAC NAME: N-(3,4-dimethylphenyl)-N-ethyl-1-oxoisochromene-4-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-N-ethyl-1-oxidanylidene-isochromene-4-carboxamide
MOLECULAR FORMULA: C20H19NO3
MOLECULAR WEIGHT: 321.36976
SMILES: CCN(C1=CC(=C(C=C1)C)C)C(=O)C2=COC(=O)C3=CC=CC=C32
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