Nombre del analito

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

Fórmula molecular

C28H25F9N4O3

Peso molecular

636.52

Masa exacta

636.18

SMILES

FC(F)(F)C1=CC(C(F)(F)F)=CC(CN(C2=NC=C(O)C=N2)[C@@H]3C4=CC(C(F)(F)F)=CC=C4N([C@@H](C3)CC)C(OCC)=O)=C1

InChI

InChI=1S/C28H25F9N4O3/c1-3-19-11-23(21-10-16(26(29,30)31)5-6-22(21)41(19)25(43)44-4-2)40(24-38-12-20(42)13-39-24)14-15-7-17(27(32,33)34)9-18(8-15)28(35,36)37/h5-10,12-13,19,23,42H,3-4,11,14H2,1-2H3/t19-,23+/m1/s1

IUPAC

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

País de origen

CANADA

Formato del producto

Neat