Tuesday, November 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: S-(2-pyridyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)thiazole-4-carbothioate
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-thiazolecarbothioic acid S-(2-pyridinyl) ester
IUPAC NAME: S-pyridin-2-yl 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
SYSTEMATIC NAME: S-pyridin-2-yl 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
MOLECULAR FORMULA: C17H12N2O3S2
MOLECULAR WEIGHT: 356.41878
SMILES: C1C(OC2=CC=CC=C2O1)C3=NC(=CS3)C(=O)SC4=CC=CC=N4
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Product OPENEYE NAME: 3-(2-thienyl)-6-(trifluoromethyl)-1,2-dihydropyrazolo[3,4-b]pyridin-4-one
CAS Name: 3-thiophen-2-yl-6-(trifluoromethyl)-1,2-dihydropyrazolo[3,4-b]pyridin-4-one
IUPAC NAME: 3-thiophen-2-yl-6-(trifluoromethyl)-1,2-dihydropyrazolo[3,4-b]pyridin-4-one
SYSTEMATIC NAME: 3-thiophen-2-yl-6-(trifluoromethyl)-1,2-dihydropyrazolo[3,4-b]pyridin-4-one
MOLECULAR FORMULA: C11H6F3N3OS
MOLECULAR WEIGHT: 285.24505
SMILES: C1=CSC(=C1)C2=C3C(=O)C=C(N=C3NN2)C(F)(F)F
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Product OPENEYE NAME: S-[5-(trifluoromethyl)-2-pyridyl] 2-(2,3-dihydro-1,4-benzodioxin-3-yl)thiazole-4-carbothioate
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-thiazolecarbothioic acid S-[5-(trifluoromethyl)-2-pyridinyl] ester
IUPAC NAME: S-[5-(trifluoromethyl)pyridin-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
SYSTEMATIC NAME: S-[5-(trifluoromethyl)pyridin-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
MOLECULAR FORMULA: C18H11F3N2O3S2
MOLECULAR WEIGHT: 424.41675
SMILES: C1C(OC2=CC=CC=C2O1)C3=NC(=CS3)C(=O)SC4=NC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: S-(2-thienylmethyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)thiazole-4-carbothioate
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-thiazolecarbothioic acid S-(thiophen-2-ylmethyl) ester
IUPAC NAME: S-(thiophen-2-ylmethyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
SYSTEMATIC NAME: S-(thiophen-2-ylmethyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carbothioate
MOLECULAR FORMULA: C17H13NO3S3
MOLECULAR WEIGHT: 375.48502
SMILES: C1C(OC2=CC=CC=C2O1)C3=NC(=CS3)C(=O)SCC4=CC=CS4
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Product OPENEYE NAME: ethyl 2-[3-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
CAS Name: 2-[3-[[2-(4-chloroanilino)-2-oxoethyl]thio]-2H-1,4-benzothiazin-2-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
SYSTEMATIC NAME: ethyl 2-[3-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]ethanoate
MOLECULAR FORMULA: C20H19ClN2O3S2
MOLECULAR WEIGHT: 434.95946
SMILES: CCOC(=O)CC1C(=NC2=CC=CC=C2S1)SCC(=O)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: ethyl 2-[3-[2-(2,4-dichloroanilino)-2-oxo-ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
CAS Name: 2-[3-[[2-(2,4-dichloroanilino)-2-oxoethyl]thio]-2H-1,4-benzothiazin-2-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[2-(2,4-dichloroanilino)-2-oxoethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
SYSTEMATIC NAME: ethyl 2-[3-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]ethanoate
MOLECULAR FORMULA: C20H18Cl2N2O3S2
MOLECULAR WEIGHT: 469.40452
SMILES: CCOC(=O)CC1C(=NC2=CC=CC=C2S1)SCC(=O)NC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: ethyl 2-[3-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
CAS Name: 2-[3-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]thio]-2H-1,4-benzothiazin-2-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]acetate
SYSTEMATIC NAME: ethyl 2-[3-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-2H-1,4-benzothiazin-2-yl]ethanoate
MOLECULAR FORMULA: C21H19F3N2O3S2
MOLECULAR WEIGHT: 468.51237
SMILES: CCOC(=O)CC1C(=NC2=CC=CC=C2S1)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F
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Product OPENEYE NAME: ethyl 2-[3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-2H-1,4-benzothiazin-2-yl]acetate
CAS Name: 2-[3-[2-(4-chlorophenyl)sulfonylethylthio]-2H-1,4-benzothiazin-2-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-2H-1,4-benzothiazin-2-yl]acetate
SYSTEMATIC NAME: ethyl 2-[3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-2H-1,4-benzothiazin-2-yl]ethanoate
MOLECULAR FORMULA: C20H20ClNO4S3
MOLECULAR WEIGHT: 470.0251
SMILES: CCOC(=O)CC1C(=NC2=CC=CC=C2S1)SCCS(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 4-nitro-7-(1-piperidyl)-2,1,3-benzoxadiazole
CAS Name: 4-nitro-7-(1-piperidinyl)-2,1,3-benzoxadiazole
IUPAC NAME: 4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C11H12N4O3
MOLECULAR WEIGHT: 248.23798
SMILES: C1CCN(CC1)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
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