[2-[[2-chloranyl-5-[ethyl(phenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: [2-[[2-chloranyl-5-[ethyl(phenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [2-[2-chloro-5-[ethyl(phenyl)sulfamoyl]anilino]-2-oxo-ethyl] 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [2-[2-chloro-5-[ethyl(phenyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-chloro-5-[ethyl(phenyl)sulfamoyl]anilino]-2-oxoethyl] 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [2-[2-chloro-5-[ethyl(phenyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C26H27ClN2O5S2 MolecularWeight: 547.08598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)COC(=O)C3=CSC4=C3CCC(C4)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)COC(=O)C3=CSC4=C3CCC(C4)C

InChI

InChI=1S/C26H27ClN2O5S2/c1-3-29(18-7-5-4-6-8-18)36(32,33)19-10-12-22(27)23(14-19)28-25(30)15-34-26(31)21-16-35-24-13-17(2)9-11-20(21)24/h4-8,10,12,14,16-17H,3,9,11,13,15H2,1-2H3,(H,28,30)