2-methylsulfonyl-N-[2-(phenylsulfonylamino)-4-piperazin-1-yl-phenyl]benzenesulfonamide hydrochloride

Systemtic Name: 2-methylsulfonyl-N-[2-(phenylsulfonylamino)-4-piperazin-1-yl-phenyl]benzenesulfonamide hydrochloride Openeye Name: N-[2-(benzenesulfonamido)-4-piperazin-1-yl-phenyl]-2-methylsulfonyl-benzenesulfonamide hydrochloride CAS Name: N-[2-(benzenesulfonamido)-4-(1-piperazinyl)phenyl]-2-methylsulfonylbenzenesulfonamide hydrochloride IUPAC Name: N-[2-(benzenesulfonamido)-4-piperazin-1-ylphenyl]-2-methylsulfonylbenzenesulfonamide hydrochloride Traditional Name: N-[2-(benzenesulfonamido)-4-piperazino-phenyl]-2-mesyl-benzenesulfonamide hydrochloride Formula: C23H27ClN4O6S3 MolecularWeight: 587.13168

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=C(C=C(C=C2)N3CCNCC3)NS(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=C(C=C(C=C2)N3CCNCC3)NS(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C23H26N4O6S3.ClH/c1-34(28,29)22-9-5-6-10-23(22)36(32,33)25-20-12-11-18(27-15-13-24-14-16-27)17-21(20)26-35(30,31)19-7-3-2-4-8-19;/h2-12,17,24-26H,13-16H2,1H3;1H