N-[4-methyl-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[4-methyl-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-(3-benzylpiperazin-1-yl)-4-methyl-phenyl]-1-phenyl-methanesulfonamide CAS Name: N-[4-methyl-2-[3-(phenylmethyl)-1-piperazinyl]phenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-(3-benzylpiperazin-1-yl)-4-methylphenyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-(3-benzylpiperazino)-4-methyl-phenyl]-1-phenyl-methanesulfonamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)CC2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-20-12-13-24(27-31(29,30)19-22-10-6-3-7-11-22)25(16-20)28-15-14-26-23(18-28)17-21-8-4-2-5-9-21/h2-13,16,23,26-27H,14-15,17-19H2,1H3