N-(phenylmethyl)-2-(phenylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(phenylmethyl)-2-(phenylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-(benzenesulfonamido)-N-benzyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-(benzenesulfonamido)-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-(benzenesulfonamido)-N-benzyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-(benzenesulfonamido)-N-benzyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NS(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NS(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3S2/c25-21(23-15-16-9-3-1-4-10-16)20-18-13-7-8-14-19(18)28-22(20)24-29(26,27)17-11-5-2-6-12-17/h1-6,9-12,24H,7-8,13-15H2,(H,23,25)