4-methoxy-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1-benzothiophene-5-carboxamide

Systemtic Name: 4-methoxy-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1-benzothiophene-5-carboxamide Openeye Name: 3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-N-(3-pyridylmethyl)-2,3-dihydrobenzothiophene-5-carboxamide CAS Name: 3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-N-(3-pyridinylmethyl)-2,3-dihydro-1-benzothiophene-5-carboxamide IUPAC Name: 3-(benzenesulfonyl)-4-methoxy-1,1-dioxo-N-(pyridin-3-ylmethyl)-2,3-dihydro-1-benzothiophene-5-carboxamide Traditional Name: 3-besyl-1,1-diketo-4-methoxy-N-(3-pyridylmethyl)-2,3-dihydrobenzothiophene-5-carboxamide Formula: C22H20N2O6S2 MolecularWeight: 472.534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1C(CS2(=O)=O)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC2=C1C(CS2(=O)=O)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H20N2O6S2/c1-30-21-17(22(25)24-13-15-6-5-11-23-12-15)9-10-18-20(21)19(14-31(18,26)27)32(28,29)16-7-3-2-4-8-16/h2-12,19H,13-14H2,1H3,(H,24,25)