Wednesday, January 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide
CAS Name: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide
IUPAC NAME: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide
SYSTEMATIC NAME: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide
MOLECULAR FORMULA: C18H17N3O4S
MOLECULAR WEIGHT: 371.41028
SMILES: CCOCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-fluoro-benzamide
CAS Name: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-fluorobenzamide
IUPAC NAME: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-fluorobenzamide
SYSTEMATIC NAME: N-[3-(2-ethoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-fluoranyl-benzamide
MOLECULAR FORMULA: C18H16FN3O4S
MOLECULAR WEIGHT: 389.400743
SMILES: CCOCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=CC=C3F
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Product OPENEYE NAME: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]cyclohexanecarboxamide
CAS Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]cyclohexanecarboxamide
IUPAC NAME: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]cyclohexanecarboxamide
SYSTEMATIC NAME: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]cyclohexanecarboxamide
MOLECULAR FORMULA: C20H28N2O3S
MOLECULAR WEIGHT: 376.51292
SMILES: CCOCCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)C3CCCCC3
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Product OPENEYE NAME: N-(3-allyl-1,3-benzothiazol-2-ylidene)-5-chloro-2-nitro-benzamide
CAS Name: 5-chloro-2-nitro-N-(3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC NAME: 5-chloro-2-nitro-N-(3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
SYSTEMATIC NAME: 5-chloranyl-2-nitro-N-(3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
MOLECULAR FORMULA: C17H12ClN3O3S
MOLECULAR WEIGHT: 373.81348
SMILES: C=CCN1C2=CC=CC=C2SC1=NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: N-(3-allyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-4-cyano-benzamide
CAS Name: 4-cyano-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC NAME: 4-cyano-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
SYSTEMATIC NAME: 4-cyano-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
MOLECULAR FORMULA: C19H15N3O3S2
MOLECULAR WEIGHT: 397.4707
SMILES: CS(=O)(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)C#N)S2)CC=C
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Product OPENEYE NAME: N-(3-allyl-6-ethoxy-1,3-benzothiazol-2-ylidene)-4-[cyclohexyl(methyl)sulfamoyl]benzamide
CAS Name: 4-[cyclohexyl(methyl)sulfamoyl]-N-(6-ethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC NAME: 4-[cyclohexyl(methyl)sulfamoyl]-N-(6-ethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
SYSTEMATIC NAME: 4-[cyclohexyl(methyl)sulfamoyl]-N-(6-ethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
MOLECULAR FORMULA: C26H31N3O4S2
MOLECULAR WEIGHT: 513.67204
SMILES: CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C4CCCCC4)S2)CC=C
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Product OPENEYE NAME: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-oxo-benzo[f]chromene-2-carboxamide
CAS Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-oxo-2-benzo[f][1]benzopyrancarboxamide
IUPAC NAME: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-oxobenzo[f]chromene-2-carboxamide
SYSTEMATIC NAME: N-(6-chloranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-benzo[f]chromene-2-carboxamide
MOLECULAR FORMULA: C24H13ClN2O3S
MOLECULAR WEIGHT: 444.88962
SMILES: C#CCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O
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Product OPENEYE NAME: 4-benzoyl-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide
CAS Name: 4-benzoyl-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC NAME: 4-benzoyl-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide
SYSTEMATIC NAME: 4-(phenylcarbonyl)-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide
MOLECULAR FORMULA: C24H17N3O4S2
MOLECULAR WEIGHT: 475.53948
SMILES: C#CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4
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Product OPENEYE NAME: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[6-methyl-2-(1-oxo-3-phenoxypropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C20H20N2O4S
MOLECULAR WEIGHT: 384.4488
SMILES: CC1=CC2=C(C=C1)N(C(=NC(=O)CCOC3=CC=CC=C3)S2)CC(=O)OC
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Product OPENEYE NAME: methyl 2-[6-bromo-2-(4-phenylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[6-bromo-2-[oxo-(4-phenylphenyl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[6-bromo-2-(4-phenylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: methyl 2-[6-bromanyl-2-(4-phenylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C23H17BrN2O3S
MOLECULAR WEIGHT: 481.36168
SMILES: COC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
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Product OPENEYE NAME: N-benzyl-2-[butyl-[(3-cyanophenyl)carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]acetamide
CAS Name: 2-[butyl-[(3-cyanoanilino)-oxomethyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[butyl-[(3-cyanophenyl)carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]acetamide
SYSTEMATIC NAME: 2-[butyl-[(3-cyanophenyl)carbamoyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C31H33N5O2
MOLECULAR WEIGHT: 507.62602
SMILES: CCCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]-N-(2-methoxyethyl)cyclopropanecarboxamide
CAS Name: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)cyclopropanecarboxamide
IUPAC NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)cyclopropanecarboxamide
SYSTEMATIC NAME: N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)cyclopropanecarboxamide
MOLECULAR FORMULA: C28H35N3O4
MOLECULAR WEIGHT: 477.5952
SMILES: CCOC1=CC=C(C=C1)CN(CCC2=CNC3=CC=CC=C32)C(=O)CN(CCOC)C(=O)C4CC4
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Product OPENEYE NAME: N-benzhydryl-3-(5-methyl-2-furyl)prop-2-enamide
CAS Name: N-(diphenylmethyl)-3-(5-methyl-2-furanyl)-2-propenamide
IUPAC NAME: N-benzhydryl-3-(5-methylfuran-2-yl)prop-2-enamide
SYSTEMATIC NAME: N-(diphenylmethyl)-3-(5-methylfuran-2-yl)prop-2-enamide
MOLECULAR FORMULA: C21H19NO2
MOLECULAR WEIGHT: 317.38106
SMILES: CC1=CC=C(O1)C=CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-(4-fluorophenyl)-2-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]thiophene-3-carboxylate
CAS Name: 4-(4-fluorophenyl)-2-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(4-fluorophenyl)-2-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 4-(4-fluorophenyl)-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate
MOLECULAR FORMULA: C27H22FNO3S2
MOLECULAR WEIGHT: 491.596883
SMILES: CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4
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Product OPENEYE NAME: methyl 4-methyl-2-[(2-phenylacetyl)amino]thiazole-5-carboxylate
CAS Name: 4-methyl-2-[(1-oxo-2-phenylethyl)amino]-5-thiazolecarboxylic acid methyl ester
IUPAC NAME: methyl 4-methyl-2-[(2-phenylacetyl)amino]-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: methyl 4-methyl-2-(2-phenylethanoylamino)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C14H14N2O3S
MOLECULAR WEIGHT: 290.33756
SMILES: CC1=C(SC(=N1)NC(=O)CC2=CC=CC=C2)C(=O)OC
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