ethyl 2-[[3-methyl-4-(phenylsulfonylamino)phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-methyl-4-(phenylsulfonylamino)phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(benzenesulfonamido)-3-methyl-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[4-(benzenesulfonamido)-3-methylphenyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(benzenesulfonamido)-3-methylbenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(benzenesulfonamido)-3-methyl-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H26N2O5S2/c1-3-32-25(29)22-19-11-7-8-12-21(19)33-24(22)26-23(28)17-13-14-20(16(2)15-17)27-34(30,31)18-9-5-4-6-10-18/h4-6,9-10,13-15,27H,3,7-8,11-12H2,1-2H3,(H,26,28)