4-methyl-N-[(3-methylphenyl)methyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(3-methylphenyl)methyl]-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-(m-tolylmethyl)benzenesulfonamide CAS Name: 4-methyl-N-[(3-methylphenyl)methyl]-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(3-methylphenyl)methyl]-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-(3-methylbenzyl)benzenesulfonamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC(=C2)C)CC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC(=C2)C)CC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C22H29N3O3S/c1-18-7-9-21(10-8-18)29(27,28)25(16-20-6-4-5-19(2)15-20)17-22(26)24-13-11-23(3)12-14-24/h4-10,15H,11-14,16-17H2,1-3H3/p+1