N-[(3-methylphenyl)methyl]-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide

Systemtic Name: N-[(3-methylphenyl)methyl]-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide Openeye Name: 3-(benzenesulfonyl)-N-(m-tolylmethyl)-1,1-dioxo-2,3-dihydrobenzothiophene-4-carboxamide CAS Name: 3-(benzenesulfonyl)-N-[(3-methylphenyl)methyl]-1,1-dioxo-2,3-dihydro-1-benzothiophene-4-carboxamide IUPAC Name: 3-(benzenesulfonyl)-N-[(3-methylphenyl)methyl]-1,1-dioxo-2,3-dihydro-1-benzothiophene-4-carboxamide Traditional Name: 3-besyl-1,1-diketo-N-(3-methylbenzyl)-2,3-dihydrobenzothiophene-4-carboxamide Formula: C23H21NO5S2 MolecularWeight: 455.54654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=C3C(CS(=O)(=O)C3=CC=C2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21NO5S2/c1-16-7-5-8-17(13-16)14-24-23(25)19-11-6-12-20-22(19)21(15-30(20,26)27)31(28,29)18-9-3-2-4-10-18/h2-13,21H,14-15H2,1H3,(H,24,25)