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

Systemtic Name: N-[4-methyl-2-[3-(phenylsulfonyl)piperazin-1-yl]phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: N-[2-[3-(benzenesulfonyl)piperazin-1-yl]-4-methyl-phenyl]-2-hydroxy-benzenesulfonamide CAS Name: N-[2-[3-(benzenesulfonyl)-1-piperazinyl]-4-methylphenyl]-2-hydroxybenzenesulfonamide IUPAC Name: N-[2-[3-(benzenesulfonyl)piperazin-1-yl]-4-methylphenyl]-2-hydroxybenzenesulfonamide Traditional Name: N-[2-(3-besylpiperazino)-4-methyl-phenyl]-2-hydroxy-benzenesulfonamide Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O5S2/c1-17-11-12-19(25-33(30,31)22-10-6-5-9-21(22)27)20(15-17)26-14-13-24-23(16-26)32(28,29)18-7-3-2-4-8-18/h2-12,15,23-25,27H,13-14,16H2,1H3