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

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-carbamoylbenzyl)-1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H13F3N6O3 MolecularWeight: 406.31873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=C(N(N=C2)C3=NNC(=O)C=C3)C(F)(F)F)C(=O)N

InChI

InChI=1S/C17H13F3N6O3/c18-17(19,20)14-11(8-23-26(14)12-5-6-13(27)25-24-12)16(29)22-7-9-1-3-10(4-2-9)15(21)28/h1-6,8H,7H2,(H2,21,28)(H,22,29)(H,25,27)