2-[(4-chlorophenyl)methylamino]-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylamino]-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-chlorophenyl)methylamino]-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylamino]-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(4-chlorophenyl)methylamino]-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-chlorobenzyl)amino]-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C12H9ClF3N3O MolecularWeight: 303.66757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC(=O)C=C(N2)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC(=O)C=C(N2)C(F)(F)F)Cl

InChI

InChI=1S/C12H9ClF3N3O/c13-8-3-1-7(2-4-8)6-17-11-18-9(12(14,15)16)5-10(20)19-11/h1-5H,6H2,(H2,17,18,19,20)