Sunday, May 26, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C20H25N3O3S
MOLECULAR WEIGHT: 387.4958
SMILES: C[C@H]1CCCC[C@@H]1NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(1R,2R)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(1R,2R)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1R,2R)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C20H25N3O3S
MOLECULAR WEIGHT: 387.4958
SMILES: C[C@@H]1CCCC[C@H]1NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(1R,2S)-2-methylcyclohexyl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(1R,2S)-2-methylcyclohexyl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1R,2S)-2-methylcyclohexyl]ethanamide
MOLECULAR FORMULA: C20H25N3O3S
MOLECULAR WEIGHT: 387.4958
SMILES: C[C@H]1CCCC[C@H]1NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(2-ethyl-6-methylphenyl)acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide
MOLECULAR FORMULA: C22H23N3O3S
MOLECULAR WEIGHT: 409.50132
SMILES: CCC1=CC=CC(=C1NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3)C
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(5-methylisoxazol-3-yl)acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide
MOLECULAR FORMULA: C17H16N4O4S
MOLECULAR WEIGHT: 372.39834
SMILES: CC1=CC(=NO1)NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1R)-1,2-dimethylpropyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(2R)-3-methylbutan-2-yl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(2R)-3-methylbutan-2-yl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(2R)-3-methylbutan-2-yl]ethanamide
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)N[C@H](C)C(C)C)C(=O)C
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(1S)-1,2-dimethylpropyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(2S)-3-methylbutan-2-yl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(2S)-3-methylbutan-2-yl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(2S)-3-methylbutan-2-yl]ethanamide
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)N[C@@H](C)C(C)C)C(=O)C
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(4-methylcyclohexyl)acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(4-methylcyclohexyl)acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(4-methylcyclohexyl)acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(4-methylcyclohexyl)ethanamide
MOLECULAR FORMULA: C20H25N3O3S
MOLECULAR WEIGHT: 387.4958
SMILES: CC1CCC(CC1)NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[2-(2-thienyl)ethyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(2-thiophen-2-ylethyl)acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(2-thiophen-2-ylethyl)acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(2-thiophen-2-ylethyl)ethanamide
MOLECULAR FORMULA: C19H19N3O3S2
MOLECULAR WEIGHT: 401.50246
SMILES: CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NCCC3=CC=CS3)C(=O)C
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(1,1-dimethylpropyl)acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(2-methylbutan-2-yl)acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(2-methylbutan-2-yl)acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(2-methylbutan-2-yl)ethanamide
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: CCC(C)(C)NC(=O)CSC1=NC(=NC(=C1C(=O)C)C)C2=CC=CO2
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Product OPENEYE NAME: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(2-fluorophenyl)methyl]acetamide
CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(2-fluorophenyl)methyl]acetamide
IUPAC NAME: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(2-fluorophenyl)methyl]acetamide
SYSTEMATIC NAME: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(2-fluorophenyl)methyl]ethanamide
MOLECULAR FORMULA: C20H18FN3O3S
MOLECULAR WEIGHT: 399.438623
SMILES: CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NCC3=CC=CC=C3F)C(=O)C
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Product OPENEYE NAME: 2,4-dimethyl-6-(4-oxo-4-phenyl-butyl)sulfanyl-pyrimidine-5-carbonitrile
CAS Name: 2,4-dimethyl-6-[(4-oxo-4-phenylbutyl)thio]-5-pyrimidinecarbonitrile
IUPAC NAME: 2,4-dimethyl-6-(4-oxo-4-phenylbutyl)sulfanylpyrimidine-5-carbonitrile
SYSTEMATIC NAME: 2,4-dimethyl-6-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-pyrimidine-5-carbonitrile
MOLECULAR FORMULA: C17H17N3OS
MOLECULAR WEIGHT: 311.40138
SMILES: CC1=C(C(=NC(=N1)C)SCCCC(=O)C2=CC=CC=C2)C#N
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Product OPENEYE NAME: 3-(2-amino-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]propanamide
CAS Name: 3-(2-amino-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]propanamide
IUPAC NAME: 3-(2-amino-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]propanamide
SYSTEMATIC NAME: 3-(2-azanyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]propanamide
MOLECULAR FORMULA: C20H23F3N6O3
MOLECULAR WEIGHT: 452.43023
SMILES: CC1=C(C(=NC2=NC(=NN12)N)C)CCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC
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Product OPENEYE NAME: methyl 5-cyano-1-[(2,5-dimethylphenyl)methyl]-6-oxo-pyridine-3-carboxylate
CAS Name: 5-cyano-1-[(2,5-dimethylphenyl)methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 5-cyano-1-[(2,5-dimethylphenyl)methyl]-6-oxopyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-cyano-1-[(2,5-dimethylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylate
MOLECULAR FORMULA: C17H16N2O3
MOLECULAR WEIGHT: 296.32054
SMILES: CC1=CC(=C(C=C1)C)CN2C=C(C=C(C2=O)C#N)C(=O)OC
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Product OPENEYE NAME: methyl 5-cyano-1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate
CAS Name: 5-cyano-1-[2-[2-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 5-cyano-1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-6-oxopyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-cyano-1-[2-[[2-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate
MOLECULAR FORMULA: C20H18N4O5
MOLECULAR WEIGHT: 394.38072
SMILES: COC(=O)C1=CN(C(=O)C(=C1)C#N)CC(=O)NC2=CC=CC=C2C(=O)NC3CC3
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Product OPENEYE NAME: methyl 5-cyano-6-oxo-1-[(5-phenylisoxazol-3-yl)methyl]pyridine-3-carboxylate
CAS Name: 5-cyano-6-oxo-1-[(5-phenyl-3-isoxazolyl)methyl]-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 5-cyano-6-oxo-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]pyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-cyano-6-oxidanylidene-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]pyridine-3-carboxylate
MOLECULAR FORMULA: C18H13N3O4
MOLECULAR WEIGHT: 335.31352
SMILES: COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=NOC(=C2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 5-cyano-1-[(1-cyanoindolizin-2-yl)methyl]-6-oxo-pyridine-3-carboxylate
CAS Name: 5-cyano-1-[(1-cyano-2-indolizinyl)methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 5-cyano-1-[(1-cyanoindolizin-2-yl)methyl]-6-oxopyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-cyano-1-[(1-cyanoindolizin-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylate
MOLECULAR FORMULA: C18H12N4O3
MOLECULAR WEIGHT: 332.31288
SMILES: COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=CN3C=CC=CC3=C2C#N
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Product OPENEYE NAME: (2-oxo-2-ureido-ethyl) 2-(thiazol-4-ylmethylsulfanyl)benzoate
CAS Name: 2-(4-thiazolylmethylthio)benzoic acid [2-(carbamoylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(carbamoylamino)-2-oxoethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate
SYSTEMATIC NAME: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate
MOLECULAR FORMULA: C14H13N3O4S2
MOLECULAR WEIGHT: 351.40072
SMILES: C1=CC=C(C(=C1)C(=O)OCC(=O)NC(=O)N)SCC2=CSC=N2
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