Wednesday, February 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [2-(4-cyanoanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-cyanoanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-cyanoanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H20N2O4
MOLECULAR WEIGHT: 352.3838
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)C#N
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Product OPENEYE NAME: N-[[(1R,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[[[(1R,2R)-2-methylcyclohexyl]amino]-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[[(1R,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[[(1R,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H26N4O2S
MOLECULAR WEIGHT: 398.52174
SMILES: C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] ester
IUPAC NAME: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H20F3NO4
MOLECULAR WEIGHT: 395.37231
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=CC=C2C(F)(F)F
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Product OPENEYE NAME: [(1S)-2-(2-acetylanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(2-acetylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-acetylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(2-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: C[C@@H](C(=O)NC1=CC=CC=C1C(=O)C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(3-nitroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(3-nitroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3-nitroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H20N2O6
MOLECULAR WEIGHT: 372.3719
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: N-[[(1S,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[[[(1S,2R)-2-methylcyclohexyl]amino]-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[[(1S,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[[(1S,2R)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H26N4O2S
MOLECULAR WEIGHT: 398.52174
SMILES: C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(2-bromoanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2-bromoanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-bromoanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H20BrNO4
MOLECULAR WEIGHT: 406.2704
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=CC=C2Br
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Product OPENEYE NAME: N-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[[[(1R,2S)-2-methylcyclohexyl]amino]-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H26N4O2S
MOLECULAR WEIGHT: 398.52174
SMILES: C[C@H]1CCCC[C@H]1NC(=O)NC(=O)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: [(1R)-2-(2-acetylanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(2-acetylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-acetylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(2-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: C[C@H](C(=O)NC1=CC=CC=C1C(=O)C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H24N2O6
MOLECULAR WEIGHT: 400.42506
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=C(C(=C2)C)C)[N+](=O)[O-]
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Product OPENEYE NAME: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[[[(1S,2S)-2-methylcyclohexyl]amino]-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H26N4O2S
MOLECULAR WEIGHT: 398.52174
SMILES: C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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