N-[1,1-bis(oxidanyl)thian-4-yl]-1-(phenylsulfonyl)-4-propan-2-yl-indole-3-sulfonamide

Systemtic Name: N-[1,1-bis(oxidanyl)thian-4-yl]-1-(phenylsulfonyl)-4-propan-2-yl-indole-3-sulfonamide Openeye Name: 1-(benzenesulfonyl)-N-(1,1-dihydroxythian-4-yl)-4-isopropyl-indole-3-sulfonamide CAS Name: 1-(benzenesulfonyl)-N-(1,1-dihydroxy-4-thianyl)-4-propan-2-yl-3-indolesulfonamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,1-dihydroxythian-4-yl)-4-propan-2-ylindole-3-sulfonamide Traditional Name: 1-besyl-N-(1,1-dihydroxythian-4-yl)-4-isopropyl-indole-3-sulfonamide Formula: C22H28N2O6S3 MolecularWeight: 512.66252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)N(C=C2S(=O)(=O)NC3CCS(CC3)(O)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)N(C=C2S(=O)(=O)NC3CCS(CC3)(O)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H28N2O6S3/c1-16(2)19-9-6-10-20-22(19)21(15-24(20)33(29,30)18-7-4-3-5-8-18)32(27,28)23-17-11-13-31(25,26)14-12-17/h3-10,15-17,23,25-26H,11-14H2,1-2H3