Sunday, November 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (E)-2-(4-chlorophenyl)sulfonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
CAS Name: (E)-2-(4-chlorophenyl)sulfonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propenenitrile
IUPAC NAME: (E)-2-(4-chlorophenyl)sulfonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-(4-chlorophenyl)sulfonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
MOLECULAR FORMULA: C17H13ClN2O4S
MOLECULAR WEIGHT: 376.81412
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(\C#N)/S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-(2-thienylsulfonyl)prop-2-enenitrile
CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-thiophen-2-ylsulfonyl-2-propenenitrile
IUPAC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-thiophen-2-ylsulfonylprop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-thiophen-2-ylsulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C15H12N2O4S2
MOLECULAR WEIGHT: 348.39678
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(\C#N)/S(=O)(=O)C3=CC=CS3
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Product OPENEYE NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]prop-2-enenitrile
CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]-2-propenenitrile
IUPAC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylprop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C17H12F3N3O4S
MOLECULAR WEIGHT: 411.35509
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(\C#N)/S(=O)(=O)C3=NC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propylsulfonyl-prop-2-enenitrile
CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propylsulfonyl-2-propenenitrile
IUPAC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propylsulfonylprop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propylsulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C14H16N2O4S
MOLECULAR WEIGHT: 308.35284
SMILES: CCCS(=O)(=O)/C(=C/NC1=CC2=C(C=C1)OCCO2)/C#N
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Product OPENEYE NAME: 8-methylsulfanyl-4,5-dihydrothieno[3,4-g][2,1]benzoxazole-6-carbonitrile
CAS Name: 8-(methylthio)-4,5-dihydrothieno[3,4-g][2,1]benzoxazole-6-carbonitrile
IUPAC NAME: 8-methylsulfanyl-4,5-dihydrothieno[3,4-g][2,1]benzoxazole-6-carbonitrile
SYSTEMATIC NAME: 8-methylsulfanyl-4,5-dihydrothieno[3,4-g][2,1]benzoxazole-6-carbonitrile
MOLECULAR FORMULA: C11H8N2OS2
MOLECULAR WEIGHT: 248.32402
SMILES: CSC1=C2C(=C(S1)C#N)CCC3=CON=C32
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Product OPENEYE NAME: 2-pyrrolidin-1-yl-5-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]pyrimidin-4-amine
CAS Name: 2-(1-pyrrolidinyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]-4-pyrimidinamine
IUPAC NAME: 2-pyrrolidin-1-yl-5-[5-(trifluoromethyl)pyridin-2-yl]sulfonylpyrimidin-4-amine
SYSTEMATIC NAME: 2-pyrrolidin-1-yl-5-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-pyrimidin-4-amine
MOLECULAR FORMULA: C14H14F3N5O2S
MOLECULAR WEIGHT: 373.35347
SMILES: C1CCN(C1)C2=NC=C(C(=N2)N)S(=O)(=O)C3=NC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-propenenitrile
IUPAC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[3-(trifluoromethyl)phenyl]carbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C19H13F3N2O3
MOLECULAR WEIGHT: 374.31333
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(\C#N)/C(=O)C3=CC(=CC=C3)C(F)(F)F
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Product OPENEYE NAME: (E)-2-(4-chlorobenzoyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
CAS Name: (E)-2-[(4-chlorophenyl)-oxomethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propenenitrile
IUPAC NAME: (E)-2-(4-chlorobenzoyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-(4-chlorophenyl)carbonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
MOLECULAR FORMULA: C18H13ClN2O3
MOLECULAR WEIGHT: 340.76042
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(\C#N)/C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (Z)-2-(2-chlorobenzoyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
CAS Name: (Z)-2-[(2-chlorophenyl)-oxomethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propenenitrile
IUPAC NAME: (Z)-2-(2-chlorobenzoyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(2-chlorophenyl)carbonyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
MOLECULAR FORMULA: C18H13ClN2O3
MOLECULAR WEIGHT: 340.76042
SMILES: C1COC2=C(O1)C=CC(=C2)N/C=C(/C#N)\C(=O)C3=CC=CC=C3Cl
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Product OPENEYE NAME: N-(benzylideneamino)-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
CAS Name: 3'-(methylthio)-N-[(phenylmethylene)amino]-1'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]carboxamide
IUPAC NAME: N-(benzylideneamino)-3'-methylsulfanylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
SYSTEMATIC NAME: 3'-methylsulfanyl-N-[(phenylmethylidene)amino]spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
MOLECULAR FORMULA: C19H20N2OS4
MOLECULAR WEIGHT: 420.6349
SMILES: CSC1=C2C(=C(S1)C(=O)NN=CC3=CC=CC=C3)CCCC24SCCS4
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Product OPENEYE NAME: N-[(4-chlorophenyl)methyleneamino]-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
CAS Name: N-[(4-chlorophenyl)methylideneamino]-3'-(methylthio)-1'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]carboxamide
IUPAC NAME: N-[(4-chlorophenyl)methylideneamino]-3'-methylsulfanylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
SYSTEMATIC NAME: N-[(4-chlorophenyl)methylideneamino]-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
MOLECULAR FORMULA: C19H19ClN2OS4
MOLECULAR WEIGHT: 455.07996
SMILES: CSC1=C2C(=C(S1)C(=O)NN=CC3=CC=C(C=C3)Cl)CCCC24SCCS4
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Product OPENEYE NAME: 3'-methylsulfanyl-N-(2-thienylmethyleneamino)spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
CAS Name: 3'-(methylthio)-N-(thiophen-2-ylmethylideneamino)-1'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]carboxamide
IUPAC NAME: 3'-methylsulfanyl-N-(thiophen-2-ylmethylideneamino)spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
SYSTEMATIC NAME: 3'-methylsulfanyl-N-(thiophen-2-ylmethylideneamino)spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carboxamide
MOLECULAR FORMULA: C17H18N2OS5
MOLECULAR WEIGHT: 426.66262
SMILES: CSC1=C2C(=C(S1)C(=O)NN=CC3=CC=CS3)CCCC24SCCS4
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Product OPENEYE NAME: 3-(2,2-dimethylchroman-6-yl)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
CAS Name: 3-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-propenenitrile
IUPAC NAME: 3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile
SYSTEMATIC NAME: 3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-[3-(trifluoromethyl)phenyl]carbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C22H18F3NO2
MOLECULAR WEIGHT: 385.37903
SMILES: CC1(CCC2=C(O1)C=CC(=C2)C=C(C#N)C(=O)C3=CC(=CC=C3)C(F)(F)F)C
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Product OPENEYE NAME: methyl 4-isoxazol-3-yl-3-methyl-5-methylsulfonyl-thiophene-2-carboxylate
CAS Name: 4-(3-isoxazolyl)-3-methyl-5-methylsulfonyl-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-methyl-5-methylsulfonyl-4-(1,2-oxazol-3-yl)thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-methyl-5-methylsulfonyl-4-(1,2-oxazol-3-yl)thiophene-2-carboxylate
MOLECULAR FORMULA: C11H11NO5S2
MOLECULAR WEIGHT: 301.33874
SMILES: CC1=C(SC(=C1C2=NOC=C2)S(=O)(=O)C)C(=O)OC
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Product OPENEYE NAME: N'-(4-chlorobenzoyl)-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
CAS Name: N'-[(4-chlorophenyl)-oxomethyl]-3'-(methylthio)-1'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]carbohydrazide
IUPAC NAME: N'-(4-chlorobenzoyl)-3'-methylsulfanylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
SYSTEMATIC NAME: N'-(4-chlorophenyl)carbonyl-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
MOLECULAR FORMULA: C19H19ClN2O2S4
MOLECULAR WEIGHT: 471.07936
SMILES: CSC1=C2C(=C(S1)C(=O)NNC(=O)C3=CC=C(C=C3)Cl)CCCC24SCCS4
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Product OPENEYE NAME: N'-(2-chlorobenzoyl)-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
CAS Name: N'-[(2-chlorophenyl)-oxomethyl]-3'-(methylthio)-1'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]carbohydrazide
IUPAC NAME: N'-(2-chlorobenzoyl)-3'-methylsulfanylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
SYSTEMATIC NAME: N'-(2-chlorophenyl)carbonyl-3'-methylsulfanyl-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-2-benzothiophene]-1'-carbohydrazide
MOLECULAR FORMULA: C19H19ClN2O2S4
MOLECULAR WEIGHT: 471.07936
SMILES: CSC1=C2C(=C(S1)C(=O)NNC(=O)C3=CC=CC=C3Cl)CCCC24SCCS4
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