N5-methyl-1-(3-methylbutyl)-4-oxidanylidene-N3-[[2-(trifluoromethyloxy)phenyl]methyl]pyridine-3,5-dicarboxamide

Systemtic Name: N5-methyl-1-(3-methylbutyl)-4-oxidanylidene-N3-[[2-(trifluoromethyloxy)phenyl]methyl]pyridine-3,5-dicarboxamide Openeye Name: 1-isopentyl-N5-methyl-4-oxo-N3-[[2-(trifluoromethoxy)phenyl]methyl]pyridine-3,5-dicarboxamide CAS Name: N5-methyl-1-(3-methylbutyl)-4-oxo-N3-[[2-(trifluoromethoxy)phenyl]methyl]pyridine-3,5-dicarboxamide IUPAC Name: 5-N-methyl-1-(3-methylbutyl)-4-oxo-3-N-[[2-(trifluoromethoxy)phenyl]methyl]pyridine-3,5-dicarboxamide Traditional Name: 1-isoamyl-4-keto-N'-methyl-N-[2-(trifluoromethoxy)benzyl]dinicotinamide Formula: C21H24F3N3O4 MolecularWeight: 439.42817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)NCC2=CC=CC=C2OC(F)(F)F)C(=O)NC

Isomeric SMILES

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)NCC2=CC=CC=C2OC(F)(F)F)C(=O)NC

InChI

InChI=1S/C21H24F3N3O4/c1-13(2)8-9-27-11-15(19(29)25-3)18(28)16(12-27)20(30)26-10-14-6-4-5-7-17(14)31-21(22,23)24/h4-7,11-13H,8-10H2,1-3H3,(H,25,29)(H,26,30)