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

Systemtic Name: 4-fluoranyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(p-tolyl)benzenesulfonamide CAS Name: 4-fluoro-N-(4-methylphenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-(p-tolyl)benzenesulfonamide Formula: C20H25FN3O3S+ MolecularWeight: 406.494203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24FN3O3S/c1-16-3-7-18(8-4-16)24(15-20(25)23-13-11-22(2)12-14-23)28(26,27)19-9-5-17(21)6-10-19/h3-10H,11-15H2,1-2H3/p+1