N-(2-phenylheptyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: N-(2-phenylheptyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: N-(2-phenylheptyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: N-(2-phenylheptyl)-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: N-(2-phenylheptyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: 2-phenylheptyl-[7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amine Formula: C27H27F3N4 MolecularWeight: 464.52529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CNC1=NC=NC2=C1C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CCCCCC(CNC1=NC=NC2=C1C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C27H27F3N4/c1-2-3-5-11-21(19-9-6-4-7-10-19)17-32-26-22-14-13-20(16-24(22)33-18-34-26)25-23(27(28,29)30)12-8-15-31-25/h4,6-10,12-16,18,21H,2-3,5,11,17H2,1H3,(H,32,33,34)