N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-[3-(trifluoromethyl)phenyl]acetamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-[3-(trifluoromethyl)phenyl]acetamide Formula: C20H23F3N3O3S+ MolecularWeight: 442.47513

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O3S/c1-25-9-11-26(12-10-25)30(28,29)18-7-5-17(6-8-18)24-19(27)14-15-3-2-4-16(13-15)20(21,22)23/h2-8,13H,9-12,14H2,1H3,(H,24,27)/p+1