Wednesday, February 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-2-(2,6-dimethylanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: CC1=C(C(=CC=C1)C)NC(=O)[C@@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-3-(2-thienyl)-1,2,4-oxadiazole
CAS Name: 5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole
IUPAC NAME: 5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-3-thiophen-2-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-3-thiophen-2-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C18H14N4OS2
MOLECULAR WEIGHT: 366.45996
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CS4
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Product OPENEYE NAME: [(1S)-2-(2,6-dimethylanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: CC1=C(C(=CC=C1)C)NC(=O)[C@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO6
MOLECULAR WEIGHT: 387.4263
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2)OC)OC
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Product OPENEYE NAME: 7-hydroxy-8-methyl-4-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]chromen-2-one
CAS Name: 7-hydroxy-8-methyl-4-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1-benzopyran-2-one
IUPAC NAME: 7-hydroxy-8-methyl-4-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]chromen-2-one
SYSTEMATIC NAME: 8-methyl-4-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one
MOLECULAR FORMULA: C22H18N2O3S
MOLECULAR WEIGHT: 390.45492
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC(=O)OC4=C3C=CC(=C4C)O
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Product OPENEYE NAME: [(1S)-2-[2-(difluoromethoxy)anilino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[[2-[bis(fluoranyl)methoxy]phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H21F2NO5
MOLECULAR WEIGHT: 393.381246
SMILES: C[C@@H](C(=O)NC1=CC=CC=C1OC(F)F)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester
IUPAC NAME: [2-(2-methylsulfanylanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H23NO4S
MOLECULAR WEIGHT: 373.46592
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=CC=C2SC
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Product OPENEYE NAME: [(1R)-2-[2-(difluoromethoxy)anilino]-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[[2-[bis(fluoranyl)methoxy]phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H21F2NO5
MOLECULAR WEIGHT: 393.381246
SMILES: C[C@H](C(=O)NC1=CC=CC=C1OC(F)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-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
MOLECULAR FORMULA: C22H20N4OS
MOLECULAR WEIGHT: 388.4854
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCC(=N3)C4=CC=CC=C4
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Product OPENEYE NAME: methyl 2-[[2-[3-(2-ethoxyphenyl)propanoyloxy]acetyl]amino]benzoate
CAS Name: 2-[[2-[3-(2-ethoxyphenyl)-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC NAME: methyl 2-[[2-[3-(2-ethoxyphenyl)propanoyloxy]acetyl]amino]benzoate
SYSTEMATIC NAME: methyl 2-[2-[3-(2-ethoxyphenyl)propanoyloxy]ethanoylamino]benzoate
MOLECULAR FORMULA: C21H23NO6
MOLECULAR WEIGHT: 385.41042
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=CC=C2C(=O)OC
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Product OPENEYE NAME: N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(1S)-1-(3-chlorophenyl)ethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H20ClN3OS
MOLECULAR WEIGHT: 397.921
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@@H](C)C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: [2-(4-ethoxyanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-ethoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-ethoxyanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CCOC1=CC=C(C=C1)NC(=O)COC(=O)CCC2=CC=CC=C2OCC
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(p-tolylmethylamino)ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: CC1=CC=C(C=C1)CNC(=O)[C@@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C21H20ClN3OS
MOLECULAR WEIGHT: 397.921
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@H](C)C3=CC(=CC=C3)Cl
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