3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[2-piperidino-5-(trifluoromethyl)phenyl]benzamide Formula: C24H30F3N4O3S+ MolecularWeight: 511.58021

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

InChI

InChI=1S/C24H29F3N4O3S/c1-29-12-14-31(15-13-29)35(33,34)20-7-5-6-18(16-20)23(32)28-21-17-19(24(25,26)27)8-9-22(21)30-10-3-2-4-11-30/h5-9,16-17H,2-4,10-15H2,1H3,(H,28,32)/p+1