Wednesday, February 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-2-[(3,4-dimethoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(3,4-dimethoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C22H27NO6
MOLECULAR WEIGHT: 401.45288
SMILES: C[C@H](C(=O)NCC1=CC(=C(C=C1)OC)OC)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(3,4-difluoroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(3,4-difluoroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-difluoroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H19F2NO4
MOLECULAR WEIGHT: 363.355266
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2)F)F
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Product OPENEYE NAME: [(1S)-2-(3-chloro-4-methoxy-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22ClNO5
MOLECULAR WEIGHT: 391.84538
SMILES: C[C@@H](C(=O)NC1=CC(=C(C=C1)OC)Cl)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: ethyl 6-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 6-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 6-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C19H20N4O3S
MOLECULAR WEIGHT: 384.4521
SMILES: CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H19ClN2O4
MOLECULAR WEIGHT: 386.82886
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)C#N
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Product OPENEYE NAME: [(1R)-2-(3-chloro-4-methoxy-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22ClNO5
MOLECULAR WEIGHT: 391.84538
SMILES: C[C@H](C(=O)NC1=CC(=C(C=C1)OC)Cl)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 3-(4-fluorophenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
CAS Name: 3-(4-fluorophenyl)-5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1,2,4-oxadiazole
IUPAC NAME: 3-(4-fluorophenyl)-5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-(4-fluorophenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C20H15FN4OS
MOLECULAR WEIGHT: 378.422703
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=C(C=C4)F
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Product OPENEYE NAME: [(1S)-2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: C[C@@H](C(=O)NCC1=CC=CC=C1OC)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 3-(2-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
CAS Name: 3-(2-methoxyphenyl)-5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1,2,4-oxadiazole
IUPAC NAME: 3-(2-methoxyphenyl)-5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-(2-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H18N4O2S
MOLECULAR WEIGHT: 390.45822
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CC=C4OC
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Product OPENEYE NAME: [(1R)-2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: C[C@H](C(=O)NCC1=CC=CC=C1OC)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(4-methoxyanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-methoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-methoxyanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H23NO5
MOLECULAR WEIGHT: 357.40032
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]acetamide
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2S)-2-phenylpropyl]acetamide
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C22H23N3OS
MOLECULAR WEIGHT: 377.50252
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC[C@@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(2,5-dichloroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2,5-dichloroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2,5-dichloroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H19Cl2NO4
MOLECULAR WEIGHT: 396.26446
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: [(1S)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22FNO4
MOLECULAR WEIGHT: 359.391383
SMILES: C[C@@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]acetamide
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2R)-2-phenylpropyl]acetamide
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C22H23N3OS
MOLECULAR WEIGHT: 377.50252
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(2-chloro-4-fluoro-anilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2-chloro-4-fluoroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-chloro-4-fluoroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(2-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H19ClFNO4
MOLECULAR WEIGHT: 379.809863
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C=C(C=C2)F)Cl
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Product OPENEYE NAME: N-[4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]phenyl]butanamide
CAS Name: N-[4-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]phenyl]butanamide
IUPAC NAME: N-[4-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]phenyl]butanamide
SYSTEMATIC NAME: N-[4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]phenyl]butanamide
MOLECULAR FORMULA: C23H23N3O2S
MOLECULAR WEIGHT: 405.51262
SMILES: CCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)C)C3=CC=CC=C3
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Product OPENEYE NAME: [(1R)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22FNO4
MOLECULAR WEIGHT: 359.391383
SMILES: C[C@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(3-chloro-4-methoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3-chloro-4-methoxyanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22ClNO5
MOLECULAR WEIGHT: 391.84538
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2)OC)Cl
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