ODM-201-d3

Analyte Name

Darolutamide-d3

Molecular Formula

C19 D3 H16 Cl N6 O2

Molecular Weight

401.86

Accurate Mass

401.1446

SMILES

[2H]C(C)(O)c1cc(n[nH]1)C(=O)N[C@@H](C)C([2H])([2H])n2ccc(n2)c3ccc(C#N)c(Cl)c3

InChI

InChI=1S/C19H19ClN6O2/c1-11(22-19(28)18-8-17(12(2)27)23-24-18)10-26-6-5-16(25-26)13-3-4-14(9-21)15(20)7-13/h3-8,11-12,27H,10H2,1-2H3,(H,22,28)(H,23,24)/t11-,12?/m0/s1/i10D2,12D

IUPAC

N-[(1S)-2-[3-(3-chloro-4-cyano-phenyl)pyrazol-1-yl]-2,2-dideuterio-1-methyl-ethyl]-5-(1-deuterio-1-hydroxy-ethyl)-1H-pyrazole-3-carboxamide

Unlabelled CAS Number

1297538-32-9

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat