4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C20H27N4O3S+ MolecularWeight: 403.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C20H26N4O3S/c1-15-4-5-16(2)19(14-15)28(26,27)22-18-8-6-17(7-9-18)20(25)21-24-12-10-23(3)11-13-24/h4-9,14,22H,10-13H2,1-3H3,(H,21,25)/p+1