4-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzenesulfonamide CAS Name: 4-methyl-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzenesulfonamide Formula: C17H24N4O2S+2 MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C[NH+]=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C[NH+]=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H22N4O2S/c1-14-3-6-16(7-4-14)24(22,23)19-15-5-8-17(18-13-15)21-11-9-20(2)10-12-21/h3-8,13,19H,9-12H2,1-2H3/p+2