2-(diphenylamino)-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(diphenylamino)-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-(N-phenylanilino)-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-(N-phenylanilino)-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(N-phenylanilino)-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-(N-phenylanilino)-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C17H12F3N3O MolecularWeight: 331.29189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=NC(=O)C=C(N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=NC(=O)C=C(N3)C(F)(F)F

InChI

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