6-(8-ethylquinolin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: 6-(8-ethylquinolin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: 6-(8-ethyl-7-quinolyl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: 6-(8-ethyl-7-quinolinyl)-N-[4-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: 6-(8-ethylquinolin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: [6-(8-ethyl-7-quinolyl)pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C22H17F3N4 MolecularWeight: 394.39239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1N=CC=C2)C3=CC(=NC=N3)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCC1=C(C=CC2=C1N=CC=C2)C3=CC(=NC=N3)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N4/c1-2-17-18(10-5-14-4-3-11-26-21(14)17)19-12-20(28-13-27-19)29-16-8-6-15(7-9-16)22(23,24)25/h3-13H,2H2,1H3,(H,27,28,29)