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

Systemtic Name: N-[2-(4-methylphenyl)-2-[3-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(3-benzylpiperazin-1-yl)-2-(p-tolyl)ethyl]benzenesulfonamide CAS Name: N-[2-(4-methylphenyl)-2-[3-(phenylmethyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(3-benzylpiperazin-1-yl)-2-(4-methylphenyl)ethyl]benzenesulfonamide Traditional Name: N-[2-(3-benzylpiperazino)-2-(p-tolyl)ethyl]benzenesulfonamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S/c1-21-12-14-23(15-13-21)26(19-28-32(30,31)25-10-6-3-7-11-25)29-17-16-27-24(20-29)18-22-8-4-2-5-9-22/h2-15,24,26-28H,16-20H2,1H3