Saturday, February 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-[(3-bromophenyl)methyl]-7-tert-butyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-4-one
CAS Name: 3-[(3-bromophenyl)methyl]-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
IUPAC NAME: 3-[(3-bromophenyl)methyl]-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
SYSTEMATIC NAME: 3-[(3-bromophenyl)methyl]-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-4-one
MOLECULAR FORMULA: C20H22BrN3OS
MOLECULAR WEIGHT: 432.37718
SMILES: CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC4=CC(=CC=C4)Br
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Product OPENEYE NAME: 7-tert-butyl-3-[(2,3,6-trichlorophenyl)methyl]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-4-one
CAS Name: 7-tert-butyl-3-[(2,3,6-trichlorophenyl)methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
IUPAC NAME: 7-tert-butyl-3-[(2,3,6-trichlorophenyl)methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
SYSTEMATIC NAME: 7-tert-butyl-3-[[2,3,6-tris(chloranyl)phenyl]methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-4-one
MOLECULAR FORMULA: C20H20Cl3N3OS
MOLECULAR WEIGHT: 456.8163
SMILES: CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC4=C(C=CC(=C4Cl)Cl)Cl
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Product OPENEYE NAME: isopropyl 4-[(7-tert-butyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)methyl]benzoate
CAS Name: 4-[(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)methyl]benzoic acid propan-2-yl ester
IUPAC NAME: propan-2-yl 4-[(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)methyl]benzoate
SYSTEMATIC NAME: propan-2-yl 4-[(7-tert-butyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)methyl]benzoate
MOLECULAR FORMULA: C24H29N3O3S
MOLECULAR WEIGHT: 439.57036
SMILES: CC(C)OC(=O)C1=CC=C(C=C1)CN2C(=O)C3=C(N=N2)SC4=C3CCC(C4)C(C)(C)C
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Product OPENEYE NAME: 2-phenoxyethyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetate
CAS Name: 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetic acid 2-phenoxyethyl ester
IUPAC NAME: 2-phenoxyethyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetate
SYSTEMATIC NAME: 2-phenoxyethyl 2-(7-tert-butyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanoate
MOLECULAR FORMULA: C23H27N3O4S
MOLECULAR WEIGHT: 441.54318
SMILES: CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)OCCOC4=CC=CC=C4
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Product OPENEYE NAME: butyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)propanoate
CAS Name: 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)propanoic acid butyl ester
IUPAC NAME: butyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)propanoate
SYSTEMATIC NAME: butyl 2-(7-tert-butyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)propanoate
MOLECULAR FORMULA: C20H29N3O3S
MOLECULAR WEIGHT: 391.52756
SMILES: CCCCOC(=O)C(C)N1C(=O)C2=C(N=N1)SC3=C2CCC(C3)C(C)(C)C
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Product OPENEYE NAME: (2-chlorophenyl)methyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)propanoate
CAS Name: 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)propanoic acid (2-chlorophenyl)methyl ester
IUPAC NAME: (2-chlorophenyl)methyl 2-(7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)propanoate
SYSTEMATIC NAME: (2-chlorophenyl)methyl 2-(7-tert-butyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)propanoate
MOLECULAR FORMULA: C23H26ClN3O3S
MOLECULAR WEIGHT: 459.98884
SMILES: CC(C(=O)OCC1=CC=CC=C1Cl)N2C(=O)C3=C(N=N2)SC4=C3CCC(C4)C(C)(C)C
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Product OPENEYE NAME: 1-(5-chloro-2-thienyl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one
CAS Name: 1-(5-chloro-2-thiophenyl)-3-(1,5-dimethyl-4-pyrazolyl)-2-propen-1-one
IUPAC NAME: 1-(5-chlorothiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one
SYSTEMATIC NAME: 1-(5-chloranylthiophen-2-yl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one
MOLECULAR FORMULA: C12H11ClN2OS
MOLECULAR WEIGHT: 266.74654
SMILES: CC1=C(C=NN1C)C=CC(=O)C2=CC=C(S2)Cl
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Product OPENEYE NAME: ethyl 6-amino-5-cyano-3-methyl-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-cyclohexane]-1'-carboxylate
CAS Name: 6-amino-5-cyano-3-methyl-1'-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-cyclohexane]carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-amino-5-cyano-3-methylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-cyclohexane]-1'-carboxylate
SYSTEMATIC NAME: ethyl 6-azanyl-5-cyano-3-methyl-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-cyclohexane]-1'-carboxylate
MOLECULAR FORMULA: C16H20N4O3
MOLECULAR WEIGHT: 316.355
SMILES: CCOC(=O)C1CCC2(CC1)C(=C(OC3=NNC(=C23)C)N)C#N
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Product OPENEYE NAME: ethyl 2-[[1-(4-cyclohexylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-(2,3-dimethoxyphenyl)-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS Name: 2-[[1-(4-cyclohexylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-5-(2,3-dimethoxyphenyl)-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[[1-(4-cyclohexylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-5-(2,3-dimethoxyphenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[[1-(4-cyclohexylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-5-(2,3-dimethoxyphenyl)-3-oxidanylidene-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C42H43N3O5S
MOLECULAR WEIGHT: 701.87292
SMILES: CCOC(=O)C1=C(N=C2N(C1C3=C(C(=CC=C3)OC)OC)C(=O)C(=CC4=C(N(C(=C4)C)C5=CC=C(C=C5)C6CCCCC6)C)S2)C7=CC=CC=C7
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Product OPENEYE NAME: methyl 4-[5-[[3-(4-chlorophenyl)-2-imino-4-oxo-thiazolidin-5-ylidene]methyl]-2-furyl]benzoate
CAS Name: 4-[5-[[3-(4-chlorophenyl)-2-imino-4-oxo-5-thiazolidinylidene]methyl]-2-furanyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[5-[[3-(4-chlorophenyl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoate
SYSTEMATIC NAME: methyl 4-[5-[[2-azanylidene-3-(4-chlorophenyl)-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoate
MOLECULAR FORMULA: C22H15ClN2O4S
MOLECULAR WEIGHT: 438.8835
SMILES: COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=N)S3)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: ethyl 5-(1,3-benzodioxol-5-yl)-2-[(4-benzyloxy-5-bromo-cyclohexa-2,4-dien-1-yl)methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS Name: 5-(1,3-benzodioxol-5-yl)-2-[(5-bromo-4-phenylmethoxy-1-cyclohexa-2,4-dienyl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
IUPAC NAME: ethyl 5-(1,3-benzodioxol-5-yl)-2-[(5-bromo-4-phenylmethoxycyclohexa-2,4-dien-1-yl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 5-(1,3-benzodioxol-5-yl)-2-[(5-bromanyl-4-phenylmethoxy-cyclohexa-2,4-dien-1-yl)methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C31H27BrN2O6S
MOLECULAR WEIGHT: 635.52488
SMILES: CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5CC(=C(C=C5)OCC6=CC=CC=C6)Br)S2)C
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