Saturday, November 24, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-(4-chlorophenyl)-4-cyano-N-cyclopropyl-5-methylsulfanyl-thiophene-2-carboxamide
CAS Name: 3-(4-chlorophenyl)-4-cyano-N-cyclopropyl-5-(methylthio)-2-thiophenecarboxamide
IUPAC NAME: 3-(4-chlorophenyl)-4-cyano-N-cyclopropyl-5-methylsulfanylthiophene-2-carboxamide
SYSTEMATIC NAME: 3-(4-chlorophenyl)-4-cyano-N-cyclopropyl-5-methylsulfanyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C16H13ClN2OS2
MOLECULAR WEIGHT: 348.87022
SMILES: CSC1=C(C(=C(S1)C(=O)NC2CC2)C3=CC=C(C=C3)Cl)C#N
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Product OPENEYE NAME: phenyl N-[[2-(trifluoromethoxy)phenyl]carbamothioyl]carbamate
CAS Name: N-[sulfanylidene-[2-(trifluoromethoxy)anilino]methyl]carbamic acid phenyl ester
IUPAC NAME: phenyl N-[[2-(trifluoromethoxy)phenyl]carbamothioyl]carbamate
SYSTEMATIC NAME: phenyl N-[[2-(trifluoromethyloxy)phenyl]carbamothioyl]carbamate
MOLECULAR FORMULA: C15H11F3N2O3S
MOLECULAR WEIGHT: 356.31965
SMILES: C1=CC=C(C=C1)OC(=O)NC(=S)NC2=CC=CC=C2OC(F)(F)F
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Product OPENEYE NAME: (3E)-3-[[(4-cyclopropyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylene]-1-methyl-2,2-dioxo-thieno[3,2-c]thiazin-4-one
CAS Name: (3E)-3-[[[4-cyclopropyl-6-(methylthio)-1,3,5-triazin-2-yl]amino]methylidene]-1-methyl-2,2-dioxo-4-thieno[3,2-c]thiazinone
IUPAC NAME: (3E)-3-[[(4-cyclopropyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylidene]-1-methyl-2,2-dioxothieno[3,2-c]thiazin-4-one
SYSTEMATIC NAME: (3E)-3-[[(4-cyclopropyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylidene]-1-methyl-2,2-bis(oxidanylidene)thieno[3,2-c][1,2]thiazin-4-one
MOLECULAR FORMULA: C15H15N5O3S3
MOLECULAR WEIGHT: 409.5063
SMILES: CN1C2=C(C(=O)/C(=C\NC3=NC(=NC(=N3)C4CC4)SC)/S1(=O)=O)SC=C2
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Product OPENEYE NAME: (3E)-1-methyl-3-[[(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylene]-2,2-dioxo-thieno[3,2-c]thiazin-4-one
CAS Name: (3E)-1-methyl-3-[[[4-methyl-6-(methylthio)-1,3,5-triazin-2-yl]amino]methylidene]-2,2-dioxo-4-thieno[3,2-c]thiazinone
IUPAC NAME: (3E)-1-methyl-3-[[(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylidene]-2,2-dioxothieno[3,2-c]thiazin-4-one
SYSTEMATIC NAME: (3E)-1-methyl-3-[[(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]methylidene]-2,2-bis(oxidanylidene)thieno[3,2-c][1,2]thiazin-4-one
MOLECULAR FORMULA: C13H13N5O3S3
MOLECULAR WEIGHT: 383.46902
SMILES: CC1=NC(=NC(=N1)SC)N/C=C/2\C(=O)C3=C(C=CS3)N(S2(=O)=O)C
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Product OPENEYE NAME: N-(4-chlorophenyl)-2-[(4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]acetamide
CAS Name: N-(4-chlorophenyl)-2-[(4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)thio]acetamide
IUPAC NAME: N-(4-chlorophenyl)-2-[(4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-2-[(4-oxidanylidene-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C19H16ClNO2S2
MOLECULAR WEIGHT: 389.91884
SMILES: C1C(SC(=CC1=O)SCC(=O)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3
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Product OPENEYE NAME: 4-bromo-3-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)-1-methyl-pyrazole
CAS Name: 4-bromo-3-(5-bromo-3,4-dimethyl-2-thieno[2,3-b]thiophenyl)-1-methylpyrazole
IUPAC NAME: 4-bromo-3-(5-bromo-3,4-dimethylthieno[2,3-b]thiophen-2-yl)-1-methylpyrazole
SYSTEMATIC NAME: 4-bromanyl-3-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)-1-methyl-pyrazole
MOLECULAR FORMULA: C12H10Br2N2S2
MOLECULAR WEIGHT: 406.1592
SMILES: CC1=C(SC2=C1C(=C(S2)Br)C)C3=NN(C=C3Br)C
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Product OPENEYE NAME: phenyl N-[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)carbamothioyl]carbamate
CAS Name: N-[[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)amino]-sulfanylidenemethyl]carbamic acid phenyl ester
IUPAC NAME: phenyl N-[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)carbamothioyl]carbamate
SYSTEMATIC NAME: phenyl N-[(methyl-oxidanylidene-phenyl-$l^{6}-sulfanylidene)carbamothioyl]carbamate
MOLECULAR FORMULA: C15H14N2O3S2
MOLECULAR WEIGHT: 334.41326
SMILES: CS(=NC(=S)NC(=O)OC1=CC=CC=C1)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: phenyl N-[[(4-chlorophenyl)-methyl-oxo-$l^{6}-sulfanylidene]carbamothioyl]carbamate
CAS Name: N-[[[(4-chlorophenyl)-methyl-oxo-$l^{6}-sulfanylidene]amino]-sulfanylidenemethyl]carbamic acid phenyl ester
IUPAC NAME: phenyl N-[[(4-chlorophenyl)-methyl-oxo-$l^{6}-sulfanylidene]carbamothioyl]carbamate
SYSTEMATIC NAME: phenyl N-[[(4-chlorophenyl)-methyl-oxidanylidene-$l^{6}-sulfanylidene]carbamothioyl]carbamate
MOLECULAR FORMULA: C15H13ClN2O3S2
MOLECULAR WEIGHT: 368.85832
SMILES: CS(=NC(=S)NC(=O)OC1=CC=CC=C1)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 5-[3-(dimethylamino)prop-2-enoyl]thiophene-2-carbonitrile
CAS Name: 5-[3-(dimethylamino)-1-oxoprop-2-enyl]-2-thiophenecarbonitrile
IUPAC NAME: 5-[3-(dimethylamino)prop-2-enoyl]thiophene-2-carbonitrile
SYSTEMATIC NAME: 5-[3-(dimethylamino)prop-2-enoyl]thiophene-2-carbonitrile
MOLECULAR FORMULA: C10H10N2OS
MOLECULAR WEIGHT: 206.2642
SMILES: CN(C)C=CC(=O)C1=CC=C(S1)C#N
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-(4-chlorophenyl)sulfonyl-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C22H19ClN2O2S2
MOLECULAR WEIGHT: 442.98146
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-methylsulfonyl-prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-methylsulfonyl-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-methylsulfonylprop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-methylsulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C17H18N2O2S2
MOLECULAR WEIGHT: 346.46702
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-(3-chlorophenyl)sulfonyl-prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-(3-chlorophenyl)sulfonyl-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(3-chlorophenyl)sulfonylprop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(3-chlorophenyl)sulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C22H19ClN2O2S2
MOLECULAR WEIGHT: 442.98146
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: 5-acetyl-1,3-dimethyl-indolin-2-one
CAS Name: 5-acetyl-1,3-dimethyl-3H-indol-2-one
IUPAC NAME: 5-acetyl-1,3-dimethyl-3H-indol-2-one
SYSTEMATIC NAME: 5-ethanoyl-1,3-dimethyl-3H-indol-2-one
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: CC1C2=C(C=CC(=C2)C(=O)C)N(C1=O)C
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-(4-chlorobenzoyl)prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-[(4-chlorophenyl)-oxomethyl]-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(4-chlorobenzoyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(4-chlorophenyl)carbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C23H19ClN2OS
MOLECULAR WEIGHT: 406.92776
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C21H18N2OS2
MOLECULAR WEIGHT: 378.51042
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)C(=O)C3=CC=CS3
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Product OPENEYE NAME: 3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
CAS Name: 3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-propenenitrile
IUPAC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]carbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C24H19F3N2OS
MOLECULAR WEIGHT: 440.48067
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)C(=O)C3=CC(=CC=C3)C(F)(F)F
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Product OPENEYE NAME: 5-(2-thioxo-1H-pyrimidin-6-yl)thiophene-2-carbonitrile
CAS Name: 5-(2-sulfanylidene-1H-pyrimidin-6-yl)-2-thiophenecarbonitrile
IUPAC NAME: 5-(2-sulfanylidene-1H-pyrimidin-6-yl)thiophene-2-carbonitrile
SYSTEMATIC NAME: 5-(2-sulfanylidene-1H-pyrimidin-6-yl)thiophene-2-carbonitrile
MOLECULAR FORMULA: C9H5N3S2
MOLECULAR WEIGHT: 219.2861
SMILES: C1=C(SC(=C1)C2=CC=NC(=S)N2)C#N
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Product OPENEYE NAME: [[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino] 4-chlorobenzoate
CAS Name: 4-chlorobenzoic acid [[1-oxo-2-(3-oxo-4H-1,4-benzothiazin-2-yl)ethyl]amino] ester
IUPAC NAME: [[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino] 4-chlorobenzoate
SYSTEMATIC NAME: [2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino] 4-chloranylbenzoate
MOLECULAR FORMULA: C17H13ClN2O4S
MOLECULAR WEIGHT: 376.81412
SMILES: C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)NOC(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-allylsulfanyl-4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)pyrimidine
CAS Name: 4-(3,4-dimethyl-5-thieno[2,3-b]thiophenyl)-2-(prop-2-enylthio)pyrimidine
IUPAC NAME: 4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)-2-prop-2-enylsulfanylpyrimidine
SYSTEMATIC NAME: 4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)-2-prop-2-enylsulfanyl-pyrimidine
MOLECULAR FORMULA: C15H14N2S3
MOLECULAR WEIGHT: 318.48006
SMILES: CC1=CSC2=C1C(=C(S2)C3=NC(=NC=C3)SCC=C)C
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Product OPENEYE NAME: 4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)-2-prop-2-ynylsulfanyl-pyrimidine
CAS Name: 4-(3,4-dimethyl-5-thieno[2,3-b]thiophenyl)-2-(prop-2-ynylthio)pyrimidine
IUPAC NAME: 4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)-2-prop-2-ynylsulfanylpyrimidine
SYSTEMATIC NAME: 4-(3,4-dimethylthieno[2,3-b]thiophen-5-yl)-2-prop-2-ynylsulfanyl-pyrimidine
MOLECULAR FORMULA: C15H12N2S3
MOLECULAR WEIGHT: 316.46418
SMILES: CC1=CSC2=C1C(=C(S2)C3=NC(=NC=C3)SCC#C)C
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