Analyte Name

Apafant-d8

CAS Number

1185101-22-7

Molecular Formula

C22H14D8ClN5O2S

Molecular Weight

464.01

Accurate Mass

463.17

SMILES

C(CC(=O)N1C(C(OC(C1([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])C2=CC3=C(N4C(CN=C3C5=C(Cl)C=CC=C5)=NN=C4C)S2

InChI

InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3/i8D2,9D2,10D2,11D2

IUPAC

3-(4-(2-chlorophenyl)-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-2-yl)-1-(morpholino-d8)propan-1-one

Unlabelled CAS Number

105219-56-5

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API

Product Format

Neat