1,1-bis(oxidanylidene)-N-(phenylmethyl)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide

Systemtic Name: 1,1-bis(oxidanylidene)-N-(phenylmethyl)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide Openeye Name: 3-(benzenesulfonyl)-N-benzyl-1,1-dioxo-2,3-dihydrobenzothiophene-4-carboxamide CAS Name: 3-(benzenesulfonyl)-1,1-dioxo-N-(phenylmethyl)-2,3-dihydro-1-benzothiophene-4-carboxamide IUPAC Name: 3-(benzenesulfonyl)-N-benzyl-1,1-dioxo-2,3-dihydro-1-benzothiophene-4-carboxamide Traditional Name: N-benzyl-3-besyl-1,1-diketo-2,3-dihydrobenzothiophene-4-carboxamide Formula: C22H19NO5S2 MolecularWeight: 441.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC=C2S1(=O)=O)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C=CC=C2S1(=O)=O)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19NO5S2/c24-22(23-14-16-8-3-1-4-9-16)18-12-7-13-19-21(18)20(15-29(19,25)26)30(27,28)17-10-5-2-6-11-17/h1-13,20H,14-15H2,(H,23,24)