2-phenyl-4-[(pyridin-2-ylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 2-phenyl-4-[(pyridin-2-ylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 2-phenyl-4-[(2-pyridylamino)methylene]-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-phenyl-4-[(2-pyridinylamino)methylidene]-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-phenyl-4-[(pyridin-2-ylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-phenyl-4-[(2-pyridylamino)methylene]-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C16H11F3N4O MolecularWeight: 332.27995

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC=N3)C(=N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC=N3)C(=N2)C(F)(F)F

InChI

InChI=1S/C16H11F3N4O/c17-16(18,19)14-12(10-21-13-8-4-5-9-20-13)15(24)23(22-14)11-6-2-1-3-7-11/h1-10H,(H,20,21)