4-chloranyl-N-(2-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(o-tolyl)benzenesulfonamide CAS Name: 4-chloro-N-(2-methylphenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-(o-tolyl)benzenesulfonamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)N2CC[NH+](CC2)C)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)N2CC[NH+](CC2)C)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-16-5-3-4-6-19(16)24(15-20(25)23-13-11-22(2)12-14-23)28(26,27)18-9-7-17(21)8-10-18/h3-10H,11-15H2,1-2H3/p+1