Wednesday, February 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 3-(3-methoxyphenyl)-5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
CAS Name: 3-(3-methoxyphenyl)-5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1,2,4-oxadiazole
IUPAC NAME: 3-(3-methoxyphenyl)-5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-(3-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=C4)OC
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Product OPENEYE NAME: [2-(benzylamino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester
IUPAC NAME: [2-(benzylamino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C20H23NO4
MOLECULAR WEIGHT: 341.40092
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NCC2=CC=CC=C2
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Product OPENEYE NAME: [(1R)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CCOC1=CC=CC=C1NC(=O)[C@@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-(1-cyanocyclohexyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C20H22N4OS
MOLECULAR WEIGHT: 366.47988
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC3(CCCCC3)C#N
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Product OPENEYE NAME: [2-(4-fluoroanilino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(4-fluoroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-fluoroanilino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C19H20FNO4
MOLECULAR WEIGHT: 345.364803
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)F
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Product OPENEYE NAME: (2S)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-N-(1-cyanocyclohexyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2S)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C21H24N4OS
MOLECULAR WEIGHT: 380.50646
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)NC3(CCCCC3)C#N
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Product OPENEYE NAME: [2-(2-naphthylamino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(2-naphthalenylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(naphthalen-2-ylamino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C23H23NO4
MOLECULAR WEIGHT: 377.43302
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NC2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: [(1S)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CCOC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)CCC2=CC=C(C=C2)OC
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Product OPENEYE NAME: (2R)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2R)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2R)-N-(1-cyanocyclohexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C21H24N4OS
MOLECULAR WEIGHT: 380.50646
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC3(CCCCC3)C#N
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Product OPENEYE NAME: [(1R)-2-(3-fluoro-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate
CAS Name: 3-(4-methoxyphenyl)propanoic acid [(2R)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] 3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: [(2R)-1-[(3-fluoranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C20H22FNO4
MOLECULAR WEIGHT: 359.391383
SMILES: CC1=C(C=C(C=C1)NC(=O)[C@@H](C)OC(=O)CCC2=CC=C(C=C2)OC)F
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Product OPENEYE NAME: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 3-(2-ethoxyphenyl)propanoate
CAS Name: 3-(2-ethoxyphenyl)propanoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
SYSTEMATIC NAME: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 3-(2-ethoxyphenyl)propanoate
MOLECULAR FORMULA: C21H23NO6
MOLECULAR WEIGHT: 385.41042
SMILES: CCOC1=CC=CC=C1CCC(=O)OCC(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: (2S)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C20H24N4OS
MOLECULAR WEIGHT: 368.49576
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C
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Product OPENEYE NAME: (2R)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2R)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2R)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2R)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C20H24N4OS
MOLECULAR WEIGHT: 368.49576
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C
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Product OPENEYE NAME: (2S)-N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
CAS Name: (2S)-N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide
IUPAC NAME: (2S)-N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide
SYSTEMATIC NAME: (2S)-N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide
MOLECULAR FORMULA: C20H24N4OS
MOLECULAR WEIGHT: 368.49576
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C
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