N-(2-methylphenyl)-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: N-(2-methylphenyl)-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethoxy]-N-(o-tolyl)benzenesulfonamide CAS Name: N-(2-methylphenyl)-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-N-(2-methylphenyl)benzenesulfonamide Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethoxy]-N-(o-tolyl)benzenesulfonamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-21-7-5-6-10-25(21)27-34(31,32)24-13-11-23(12-14-24)33-20-26(30)29-17-15-28(16-18-29)19-22-8-3-2-4-9-22/h2-14,27H,15-20H2,1H3