Wednesday, February 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[(2-methoxyphenyl)methyl]-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(2-methoxyphenyl)methyl]-N-methyl-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(2-methoxyphenyl)methyl]-N-methyl-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(2-methoxyphenyl)methyl]-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C22H23N3O2S
MOLECULAR WEIGHT: 393.50192
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N(C)CC3=CC=CC=C3OC
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Product OPENEYE NAME: 4-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-2-(2-thienyl)oxazole
CAS Name: 4-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-2-thiophen-2-yloxazole
IUPAC NAME: 4-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-2-thiophen-2-yl-1,3-oxazole
SYSTEMATIC NAME: 4-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-2-thiophen-2-yl-1,3-oxazole
MOLECULAR FORMULA: C19H15N3OS2
MOLECULAR WEIGHT: 365.4719
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=COC(=N3)C4=CC=CS4
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-oxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H21N3O5
MOLECULAR WEIGHT: 383.39784
SMILES: C[C@@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)OC(=O)CCC3=CC=C(C=C3)OC
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Product OPENEYE NAME: [2-(2,6-diethylanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2,6-diethylanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C23H29NO4
MOLECULAR WEIGHT: 383.48066
SMILES: CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)CCC2=CC=CC=C2OCC
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Product OPENEYE NAME: 9-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one
CAS Name: 9-methyl-2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone
IUPAC NAME: 9-methyl-2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 9-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C21H18N4OS
MOLECULAR WEIGHT: 374.45882
SMILES: CC1=CC=CN2C1=NC(=CC2=O)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-oxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H21N3O5
MOLECULAR WEIGHT: 383.39784
SMILES: C[C@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)OC(=O)CCC3=CC=C(C=C3)OC
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Product OPENEYE NAME: 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethyl]-1,1-dioxo-1,2-benzothiazol-3-one
CAS Name: 2-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethyl]-1,1-dioxo-1,2-benzothiazol-3-one
IUPAC NAME: 2-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethyl]-1,1-dioxo-1,2-benzothiazol-3-one
SYSTEMATIC NAME: 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one
MOLECULAR FORMULA: C20H17N3O3S2
MOLECULAR WEIGHT: 411.49728
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O
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Product OPENEYE NAME: [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[[2,3,4-tris(fluoranyl)phenyl]amino]ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H18F3NO4
MOLECULAR WEIGHT: 381.34573
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=C(C(=C(C=C2)F)F)F
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Product OPENEYE NAME: [(1R)-2-(2-bromo-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22BrNO4
MOLECULAR WEIGHT: 420.29698
SMILES: CC1=CC(=C(C=C1)NC(=O)[C@@H](C)OC(=O)CCC2=CC=C(C=C2)OC)Br
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Product OPENEYE NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2S)-2-phenylpropyl]propanamide
IUPAC NAME: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
SYSTEMATIC NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
MOLECULAR FORMULA: C23H25N3OS
MOLECULAR WEIGHT: 391.5291
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC[C@@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(2-methoxyanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2-methoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-methoxyanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(2-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=CC=C2OC
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Product OPENEYE NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
CAS Name: (2R)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2S)-2-phenylpropyl]propanamide
IUPAC NAME: (2R)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
SYSTEMATIC NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
MOLECULAR FORMULA: C23H25N3OS
MOLECULAR WEIGHT: 391.5291
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC[C@@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-2-(2-bromo-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22BrNO4
MOLECULAR WEIGHT: 420.29698
SMILES: CC1=CC(=C(C=C1)NC(=O)[C@H](C)OC(=O)CCC2=CC=C(C=C2)OC)Br
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Product OPENEYE NAME: [2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H24N2O7
MOLECULAR WEIGHT: 416.42446
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2C)[N+](=O)[O-])OC
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Product OPENEYE NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
CAS Name: (2S)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2R)-2-phenylpropyl]propanamide
IUPAC NAME: (2S)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
SYSTEMATIC NAME: (2S)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
MOLECULAR FORMULA: C23H25N3OS
MOLECULAR WEIGHT: 391.5291
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-[[2-[3-(2-ethoxyphenyl)propanoyloxy]acetyl]amino]benzoate
CAS Name: 4-[[2-[3-(2-ethoxyphenyl)-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[[2-[3-(2-ethoxyphenyl)propanoyloxy]acetyl]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[2-[3-(2-ethoxyphenyl)propanoyloxy]ethanoylamino]benzoate
MOLECULAR FORMULA: C22H25NO6
MOLECULAR WEIGHT: 399.437
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC
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Product OPENEYE NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
CAS Name: (2R)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(2R)-2-phenylpropyl]propanamide
IUPAC NAME: (2R)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
SYSTEMATIC NAME: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(2R)-2-phenylpropyl]propanamide
MOLECULAR FORMULA: C23H25N3OS
MOLECULAR WEIGHT: 391.5291
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-2-(5-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22ClNO4
MOLECULAR WEIGHT: 375.84598
SMILES: CC1=C(C=C(C=C1)Cl)NC(=O)[C@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: [2-(4-chloroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-chloroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-chloroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H20ClNO4
MOLECULAR WEIGHT: 361.8194
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-(2-cyanoethyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-(2-cyanoethyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-(2-cyanoethyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(2-cyanoethyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C16H16N4OS
MOLECULAR WEIGHT: 312.38944
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCCC#N
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