3-[3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[3-(p-tolyl)-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one CAS Name: 3-[3-(4-methylphenyl)-5-(trifluoromethyl)-1-pyrazolyl]-1H-pyridazin-6-one IUPAC Name: 3-[3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[3-(p-tolyl)-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Formula: C15H11F3N4O MolecularWeight: 320.26925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2)C(F)(F)F)C3=NNC(=O)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2)C(F)(F)F)C3=NNC(=O)C=C3

InChI

InChI=1S/C15H11F3N4O/c1-9-2-4-10(5-3-9)11-8-12(15(16,17)18)22(21-11)13-6-7-14(23)20-19-13/h2-8H,1H3,(H,20,23)