N-(3-methylphenyl)-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: N-(3-methylphenyl)-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethoxy]-N-(m-tolyl)benzenesulfonamide CAS Name: N-(3-methylphenyl)-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-N-(3-methylphenyl)benzenesulfonamide Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethoxy]-N-(m-tolyl)benzenesulfonamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

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