N-[(2-methylphenyl)methyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(2-methylphenyl)methyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(o-tolylmethyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-keto-1H-pyridazin-3-yl)-N-(2-methylbenzyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H14F3N5O2 MolecularWeight: 377.32057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C17H14F3N5O2/c1-10-4-2-3-5-11(10)8-21-16(27)12-9-22-25(15(12)17(18,19)20)13-6-7-14(26)24-23-13/h2-7,9H,8H2,1H3,(H,21,27)(H,24,26)