Saturday, November 24, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 6-[2-[2-(benzenesulfonyl)ethylsulfanyl]pyrimidin-4-yl]-2,7-dimethyl-pyrazolo[1,5-a]pyrimidine
CAS Name: 6-[2-[2-(benzenesulfonyl)ethylthio]-4-pyrimidinyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine
IUPAC NAME: 6-[2-[2-(benzenesulfonyl)ethylsulfanyl]pyrimidin-4-yl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2,7-dimethyl-6-[2-[2-(phenylsulfonyl)ethylsulfanyl]pyrimidin-4-yl]pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C20H19N5O2S2
MOLECULAR WEIGHT: 425.52716
SMILES: CC1=NN2C(=C(C=NC2=C1)C3=NC(=NC=C3)SCCS(=O)(=O)C4=CC=CC=C4)C
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Product OPENEYE NAME: 6-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyrimidin-5-yl]-2,7-dimethyl-pyrazolo[1,5-a]pyrimidine
CAS Name: 6-[2-[2-(4-chlorophenyl)sulfonylethylthio]-5-pyrimidinyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine
IUPAC NAME: 6-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyrimidin-5-yl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 6-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyrimidin-5-yl]-2,7-dimethyl-pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C20H18ClN5O2S2
MOLECULAR WEIGHT: 459.97222
SMILES: CC1=NN2C(=C(C=NC2=C1)C3=CN=C(N=C3)SCCS(=O)(=O)C4=CC=C(C=C4)Cl)C
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Product OPENEYE NAME: methyl 6,6-dimethyl-4-oxo-3-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 6,6-dimethyl-4-oxo-3-[[5-(trifluoromethyl)-2-pyridinyl]thio]-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 6,6-dimethyl-4-oxo-3-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: methyl 6,6-dimethyl-4-oxidanylidene-3-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C18H16F3NO3S2
MOLECULAR WEIGHT: 415.44975
SMILES: CC1(CC2=C(SC(=C2C(=O)C1)SC3=NC=C(C=C3)C(F)(F)F)C(=O)OC)C
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Product OPENEYE NAME: methyl 6,6-dimethyl-4-oxo-3-(2-thienylsulfanyl)-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 6,6-dimethyl-4-oxo-3-(thiophen-2-ylthio)-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 6,6-dimethyl-4-oxo-3-thiophen-2-ylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: methyl 6,6-dimethyl-4-oxidanylidene-3-thiophen-2-ylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C16H16O3S3
MOLECULAR WEIGHT: 352.49144
SMILES: CC1(CC2=C(SC(=C2C(=O)C1)SC3=CC=CS3)C(=O)OC)C
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Product OPENEYE NAME: ethyl 6,6-dimethyl-3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 6,6-dimethyl-3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6,6-dimethyl-3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: ethyl 6,6-dimethyl-3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C17H18F3N3O3S2
MOLECULAR WEIGHT: 433.46833
SMILES: CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)SC3=NN=C(N3C)C(F)(F)F)(C)C
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Product OPENEYE NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 4-chlorobenzoate
CAS Name: 4-chlorobenzoic acid [[7,7-dimethyl-2-(methylthio)-6,8-dihydroquinazolin-5-ylidene]amino] ester
IUPAC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 4-chlorobenzoate
SYSTEMATIC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 4-chloranylbenzoate
MOLECULAR FORMULA: C18H18ClN3O2S
MOLECULAR WEIGHT: 375.87242
SMILES: CC1(CC2=NC(=NC=C2C(=NOC(=O)C3=CC=C(C=C3)Cl)C1)SC)C
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Product OPENEYE NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 2-chlorobenzoate
CAS Name: 2-chlorobenzoic acid [[7,7-dimethyl-2-(methylthio)-6,8-dihydroquinazolin-5-ylidene]amino] ester
IUPAC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 2-chlorobenzoate
SYSTEMATIC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 2-chloranylbenzoate
MOLECULAR FORMULA: C18H18ClN3O2S
MOLECULAR WEIGHT: 375.87242
SMILES: CC1(CC2=NC(=NC=C2C(=NOC(=O)C3=CC=CC=C3Cl)C1)SC)C
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Product OPENEYE NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 3-(trifluoromethyl)benzoate
CAS Name: 3-(trifluoromethyl)benzoic acid [[7,7-dimethyl-2-(methylthio)-6,8-dihydroquinazolin-5-ylidene]amino] ester
IUPAC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 3-(trifluoromethyl)benzoate
SYSTEMATIC NAME: [(7,7-dimethyl-2-methylsulfanyl-6,8-dihydroquinazolin-5-ylidene)amino] 3-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C19H18F3N3O2S
MOLECULAR WEIGHT: 409.42533
SMILES: CC1(CC2=NC(=NC=C2C(=NOC(=O)C3=CC(=CC=C3)C(F)(F)F)C1)SC)C
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Product OPENEYE NAME: 6-chloro-3-[3-(trifluoromethyl)benzoyl]chromen-2-one
CAS Name: 6-chloro-3-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-benzopyran-2-one
IUPAC NAME: 6-chloro-3-[3-(trifluoromethyl)benzoyl]chromen-2-one
SYSTEMATIC NAME: 6-chloranyl-3-[3-(trifluoromethyl)phenyl]carbonyl-chromen-2-one
MOLECULAR FORMULA: C17H8ClF3O3
MOLECULAR WEIGHT: 352.69183
SMILES: C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CC3=C(C=CC(=C3)Cl)OC2=O
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