1-(6-oxidanylidene-1H-pyridazin-3-yl)-N-(4-phenylazanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-oxidanylidene-1H-pyridazin-3-yl)-N-(4-phenylazanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(4-anilinophenyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(4-anilinophenyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-anilinophenyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-anilinophenyl)-1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H15F3N6O2 MolecularWeight: 440.37801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

InChI

InChI=1S/C21H15F3N6O2/c22-21(23,24)19-16(12-25-30(19)17-10-11-18(31)29-28-17)20(32)27-15-8-6-14(7-9-15)26-13-4-2-1-3-5-13/h1-12,26H,(H,27,32)(H,29,31)