N-(pyridin-4-ylmethyl)-2-(6-quinolin-7-yloxypyrimidin-4-yl)-5-(trifluoromethyl)aniline

Systemtic Name: N-(pyridin-4-ylmethyl)-2-(6-quinolin-7-yloxypyrimidin-4-yl)-5-(trifluoromethyl)aniline Openeye Name: N-(4-pyridylmethyl)-2-[6-(7-quinolyloxy)pyrimidin-4-yl]-5-(trifluoromethyl)aniline CAS Name: N-(pyridin-4-ylmethyl)-2-[6-(7-quinolinyloxy)-4-pyrimidinyl]-5-(trifluoromethyl)aniline IUPAC Name: N-(pyridin-4-ylmethyl)-2-(6-quinolin-7-yloxypyrimidin-4-yl)-5-(trifluoromethyl)aniline Traditional Name: 4-pyridylmethyl-[2-[6-(7-quinolyloxy)pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]amine Formula: C26H18F3N5O MolecularWeight: 473.44923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)OC3=NC=NC(=C3)C4=C(C=C(C=C4)C(F)(F)F)NCC5=CC=NC=C5)N=C1

Isomeric SMILES

C1=CC2=C(C=C(C=C2)OC3=NC=NC(=C3)C4=C(C=C(C=C4)C(F)(F)F)NCC5=CC=NC=C5)N=C1

InChI

InChI=1S/C26H18F3N5O/c27-26(28,29)19-4-6-21(23(12-19)32-15-17-7-10-30-11-8-17)24-14-25(34-16-33-24)35-20-5-3-18-2-1-9-31-22(18)13-20/h1-14,16,32H,15H2