3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C19H24FN4O3S+ MolecularWeight: 407.482263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23FN4O3S/c1-14-6-7-17(13-18(14)20)28(26,27)22-16-5-3-4-15(12-16)19(25)21-24-10-8-23(2)9-11-24/h3-7,12-13,22H,8-11H2,1-2H3,(H,21,25)/p+1