3-chloranyl-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide Openeye Name: 3-chloro-N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]benzenesulfonamide CAS Name: 3-chloro-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]benzenesulfonamide IUPAC Name: 3-chloro-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]benzenesulfonamide Traditional Name: 3-chloro-N-[4-[4-(m-tolyl)piperazino]butyl]benzenesulfonamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H28ClN3O2S/c1-18-6-4-8-20(16-18)25-14-12-24(13-15-25)11-3-2-10-23-28(26,27)21-9-5-7-19(22)17-21/h4-9,16-17,23H,2-3,10-15H2,1H3