6-phenyl-N-[2,2,2-tris(fluoranyl)ethyl]pyrimidin-4-amine hydrochloride

Systemtic Name: 6-phenyl-N-[2,2,2-tris(fluoranyl)ethyl]pyrimidin-4-amine hydrochloride Openeye Name: 6-phenyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine hydrochloride CAS Name: 6-phenyl-N-(2,2,2-trifluoroethyl)-4-pyrimidinamine hydrochloride IUPAC Name: 6-phenyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine hydrochloride Traditional Name: (6-phenylpyrimidin-4-yl)-(2,2,2-trifluoroethyl)amine hydrochloride Formula: C12H11ClF3N3 MolecularWeight: 289.68405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC=N2)NCC(F)(F)F.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC=N2)NCC(F)(F)F.Cl

InChI

InChI=1S/C12H10F3N3.ClH/c13-12(14,15)7-16-11-6-10(17-8-18-11)9-4-2-1-3-5-9;/h1-6,8H,7H2,(H,16,17,18);1H