2-methoxy-5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 2-methoxy-5-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 2-methoxy-5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-methoxy-5-methyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C22H27F3N3O4S+ MolecularWeight: 486.52769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26F3N3O4S/c1-16-7-8-19(32-3)20(13-16)33(30,31)28(15-21(29)27-11-9-26(2)10-12-27)18-6-4-5-17(14-18)22(23,24)25/h4-8,13-14H,9-12,15H2,1-3H3/p+1