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

Systemtic Name: N-[4-methyl-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: N-[2-(3-benzylpiperazin-1-yl)-4-methyl-phenyl]-2-hydroxy-benzenesulfonamide CAS Name: 2-hydroxy-N-[4-methyl-2-[3-(phenylmethyl)-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: N-[2-(3-benzylpiperazin-1-yl)-4-methylphenyl]-2-hydroxybenzenesulfonamide Traditional Name: N-[2-(3-benzylpiperazino)-4-methyl-phenyl]-2-hydroxy-benzenesulfonamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-18-11-12-21(26-31(29,30)24-10-6-5-9-23(24)28)22(15-18)27-14-13-25-20(17-27)16-19-7-3-2-4-8-19/h2-12,15,20,25-26,28H,13-14,16-17H2,1H3