Analyte Name

Raltegravir (E/Z Mixture)-ethoxyacethydrazone

Molecular Formula

C22H27FN6O6

Molecular Weight

490.48

Accurate Mass

490.2

SMILES

FC1=CC=C(CNC(C2=C(O)C(N(C)C(C(C)(C)NC(C(N/N=C(OCC)\C)=O)=O)=N2)=O)=O)C=C1

InChI

InChI=1S/C22H27FN6O6/c1-6-35-12(2)27-28-19(33)18(32)26-22(3,4)21-25-15(16(30)20(34)29(21)5)17(31)24-11-13-7-9-14(23)10-8-13/h7-10,30H,6,11H2,1-5H3,(H,24,31)(H,26,32)(H,28,33)/b27-12+

IUPAC

ethyl (E)-N-(2-((2-(4-((4-fluorobenzyl)carbamoyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)propan-2-yl)amino)-2-oxoacetyl)acetohydrazonate

Alternate CAS Number

Keto Form: 2138805-56-6

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat