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

Systemtic Name: N-[4-(2-methylpropyl)-2-[3-(phenylsulfonyl)piperazin-1-yl]phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: N-[2-[3-(benzenesulfonyl)piperazin-1-yl]-4-isobutyl-phenyl]-2-hydroxy-benzenesulfonamide CAS Name: N-[2-[3-(benzenesulfonyl)-1-piperazinyl]-4-(2-methylpropyl)phenyl]-2-hydroxybenzenesulfonamide IUPAC Name: N-[2-[3-(benzenesulfonyl)piperazin-1-yl]-4-(2-methylpropyl)phenyl]-2-hydroxybenzenesulfonamide Traditional Name: N-[2-(3-besylpiperazino)-4-isobutyl-phenyl]-2-hydroxy-benzenesulfonamide Formula: C26H31N3O5S2 MolecularWeight: 529.67144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O5S2/c1-19(2)16-20-12-13-22(28-36(33,34)25-11-7-6-10-24(25)30)23(17-20)29-15-14-27-26(18-29)35(31,32)21-8-4-3-5-9-21/h3-13,17,19,26-28,30H,14-16,18H2,1-2H3