3-phenyl-4-[[[4-(trifluoromethyl)phenyl]amino]methylidene]-1H-pyrazol-5-one

Systemtic Name: 3-phenyl-4-[[[4-(trifluoromethyl)phenyl]amino]methylidene]-1H-pyrazol-5-one Openeye Name: 3-phenyl-4-[[4-(trifluoromethyl)anilino]methylene]-1H-pyrazol-5-one CAS Name: 3-phenyl-4-[[4-(trifluoromethyl)anilino]methylidene]-1H-pyrazol-5-one IUPAC Name: 3-phenyl-4-[[4-(trifluoromethyl)anilino]methylidene]-1H-pyrazol-5-one Traditional Name: 5-phenyl-4-[[4-(trifluoromethyl)anilino]methylene]-2-pyrazolin-3-one Formula: C17H12F3N3O MolecularWeight: 331.29189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=O)C2=CNC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=O)C2=CNC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O/c18-17(19,20)12-6-8-13(9-7-12)21-10-14-15(22-23-16(14)24)11-4-2-1-3-5-11/h1-10,21H,(H,23,24)