3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzamide IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Traditional Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Formula: C26H30FN4O3S+ MolecularWeight: 497.604803

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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)NCC[NH+]3CCN(CC3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C26H29FN4O3S/c1-20-10-11-24(19-25(20)27)35(33,34)29-22-7-5-6-21(18-22)26(32)28-12-13-30-14-16-31(17-15-30)23-8-3-2-4-9-23/h2-11,18-19,29H,12-17H2,1H3,(H,28,32)/p+1