N-[2-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-phenoxy-benzenesulfonamide

Systemtic Name: N-[2-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-phenoxy-benzenesulfonamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-2-(o-tolyl)ethyl]-4-phenoxy-benzenesulfonamide CAS Name: N-[2-(2-methylphenyl)-2-(4-methyl-1-piperazinyl)ethyl]-4-phenoxybenzenesulfonamide IUPAC Name: N-[2-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-phenoxybenzenesulfonamide Traditional Name: N-[2-(4-methylpiperazino)-2-(o-tolyl)ethyl]-4-phenoxy-benzenesulfonamide Formula: C26H31N3O3S MolecularWeight: 465.60764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CNS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=CC=C1C(CNS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)N4CCN(CC4)C

InChI

InChI=1S/C26H31N3O3S/c1-21-8-6-7-11-25(21)26(29-18-16-28(2)17-19-29)20-27-33(30,31)24-14-12-23(13-15-24)32-22-9-4-3-5-10-22/h3-15,26-27H,16-20H2,1-2H3