N-[2,6-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-N,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[2,6-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-N,4-dimethyl-benzenesulfonamide Openeye Name: N-[2,6-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-N,4-dimethyl-benzenesulfonamide CAS Name: N-[2,6-dimethyl-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-N,4-dimethylbenzenesulfonamide IUPAC Name: N-[2,6-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[2,6-dimethyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-N,4-dimethyl-benzenesulfonamide Formula: C21H30N3O4S2+ MolecularWeight: 452.6106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=CC(=C2C)S(=O)(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=CC(=C2C)S(=O)(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C21H29N3O4S2/c1-16-6-9-19(10-7-16)29(25,26)23(5)21-17(2)8-11-20(18(21)3)30(27,28)24-14-12-22(4)13-15-24/h6-11H,12-15H2,1-5H3/p+1