6-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: 6-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: 6-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: 6-methyl-N-(4-methyl-1-piperazin-4-iumyl)-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: 6-methyl-N-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-N-(4-methylpiperazin-4-ium-1-yl)-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C18H21F3N5O2+ MolecularWeight: 396.38685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C18H20F3N5O2/c1-12-11-15(27)16(17(28)23-25-9-7-24(2)8-10-25)22-26(12)14-6-4-3-5-13(14)18(19,20)21/h3-6,11H,7-10H2,1-2H3,(H,23,28)/p+1