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

Systemtic Name: N-heptan-2-yl-6-methyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: 6-methyl-N-(1-methylhexyl)-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-heptan-2-yl-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-heptan-2-yl-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-N-(1-methylhexyl)-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C20H24F3N3O2 MolecularWeight: 395.41867

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCCCCC(C)NC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C20H24F3N3O2/c1-4-5-6-9-13(2)24-19(28)18-17(27)12-14(3)26(25-18)16-11-8-7-10-15(16)20(21,22)23/h7-8,10-13H,4-6,9H2,1-3H3,(H,24,28)