3-[[2-pyridin-4-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile

Systemtic Name: 3-[[2-pyridin-4-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile Openeye Name: 3-[[2-(4-pyridyl)-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[[2-pyridin-4-yl-6-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[[2-pyridin-4-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile Traditional Name: 3-[[2-(4-pyridyl)-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propionitrile Formula: C19H14F3N5 MolecularWeight: 369.34317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=CC(=NC(=N2)C3=CC=NC=C3)NCCC#N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=CC(=NC(=N2)C3=CC=NC=C3)NCCC#N

InChI

InChI=1S/C19H14F3N5/c20-19(21,22)15-4-1-3-14(11-15)16-12-17(25-8-2-7-23)27-18(26-16)13-5-9-24-10-6-13/h1,3-6,9-12H,2,8H2,(H,25,26,27)