N-[4-tert-butyl-3-(2-dimethylaminoethyloxy)phenyl]-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: N-[4-tert-butyl-3-(2-dimethylaminoethyloxy)phenyl]-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: N-[4-tert-butyl-3-(2-dimethylaminoethyloxy)phenyl]-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: N-[4-tert-butyl-3-(2-dimethylaminoethyloxy)phenyl]-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: N-[4-tert-butyl-3-(2-dimethylaminoethyloxy)phenyl]-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: 2-[2-tert-butyl-5-[[7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amino]phenoxy]ethyl-dimethyl-amine Formula: C28H30F3N5O MolecularWeight: 509.56591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)NC2=NC=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F)OCCN(C)C

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)NC2=NC=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F)OCCN(C)C

InChI

InChI=1S/C28H30F3N5O/c1-27(2,3)21-11-9-19(16-24(21)37-14-13-36(4)5)35-26-20-10-8-18(15-23(20)33-17-34-26)25-22(28(29,30)31)7-6-12-32-25/h6-12,15-17H,13-14H2,1-5H3,(H,33,34,35)