5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide Openeye Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide CAS Name: 5-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(trifluoromethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide Traditional Name: 5-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide Formula: C18H21F3N3OS+ MolecularWeight: 384.43905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H20F3N3OS/c1-12-3-6-16(26-12)17(25)22-14-11-13(18(19,20)21)4-5-15(14)24-9-7-23(2)8-10-24/h3-6,11H,7-10H2,1-2H3,(H,22,25)/p+1