[2-(2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: [2-(2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [2-(2-methyl-5-sulfamoyl-indolin-1-yl)-2-oxo-ethyl] 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [2-(2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [2-keto-2-(2-methyl-5-sulfamoyl-indolin-1-yl)ethyl] ester Formula: C22H25N3O6S2 MolecularWeight: 491.5804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1C(=O)COC(=O)C3=C(SC4=C3CCCC4)NC(=O)C)C=CC(=C2)S(=O)(=O)N

Isomeric SMILES

CC1CC2=C(N1C(=O)COC(=O)C3=C(SC4=C3CCCC4)NC(=O)C)C=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C22H25N3O6S2/c1-12-9-14-10-15(33(23,29)30)7-8-17(14)25(12)19(27)11-31-22(28)20-16-5-3-4-6-18(16)32-21(20)24-13(2)26/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,24,26)(H2,23,29,30)