Analyte Name

Ethyl (2R,4S)-4-[(5-bromo-2-pyrimidinyl)amino]-2-ethyl-3,4-dihydro-6-(trifluoromethyl)-1(2H)-quinolinecarboxylate

CAS Number

866397-24-2

Molecular Formula

C19H20BrF3N4O2

Molecular Weight

473.29

Accurate Mass

472.07

SMILES

CCOC(N([C@@H](C1)CC)C(C([C@H]1NC2=NC=C(Br)C=N2)=C3)=CC=C3C(F)(F)F)=O

InChI

InChI=1S/C19H20BrF3N4O2/c1-3-13-8-15(26-17-24-9-12(20)10-25-17)14-7-11(19(21,22)23)5-6-16(14)27(13)18(28)29-4-2/h5-7,9-10,13,15H,3-4,8H2,1-2H3,(H,24,25,26)/t13-,15+/m1/s1

IUPAC

Ethyl (2R,4S)-4-((5-bromopyrimidin-2-yl)amino)-2-ethyl-6-(trifluoromethyl)-3,4-dihydroquinoline-1(2H)-carboxylate

Country of Origin

CANADA

Product Format

Neat