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

Systemtic Name: 4-methyl-N-(2-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(o-tolyl)benzenesulfonamide CAS Name: 4-methyl-N-(2-methylphenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-methyl-N-(2-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-methyl-N-(o-tolyl)benzenesulfonamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)C)C3=CC=CC=C3C

InChI

InChI=1S/C21H27N3O3S/c1-17-8-10-19(11-9-17)28(26,27)24(20-7-5-4-6-18(20)2)16-21(25)23-14-12-22(3)13-15-23/h4-11H,12-16H2,1-3H3/p+1