N-oxidanyl-2-[4-(phenylsulfonyl)thiophen-2-yl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-oxidanyl-2-[4-(phenylsulfonyl)thiophen-2-yl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[[4-(benzenesulfonyl)-2-thienyl]sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid CAS Name: 2-[[4-(benzenesulfonyl)-2-thiophenyl]sulfonyl]-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[4-(benzenesulfonyl)thiophen-2-yl]sulfonyl-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[(4-besyl-2-thienyl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid Formula: C20H18N2O6S3 MolecularWeight: 478.56172

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=CS3)S(=O)(=O)C4=CC=CC=C4)C(=O)NO

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=CS3)S(=O)(=O)C4=CC=CC=C4)C(=O)NO

InChI

InChI=1S/C20H18N2O6S3/c23-20(21-24)18-10-14-6-4-5-7-15(14)12-22(18)31(27,28)19-11-17(13-29-19)30(25,26)16-8-2-1-3-9-16/h1-9,11,13,18,24H,10,12H2,(H,21,23)