Analyte Name

(3aR,4S,6R,6aS)-6-((5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl)amino)tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-ol-d7

Molecular Formula

C15 D7 H16 Cl N4 O3 S

Molecular Weight

381.929

Accurate Mass

381.162

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])Sc1nc(Cl)c(N)c(N[C@@H]2C[C@H](O)[C@H]3OC(C)(C)O[C@@H]23)n1

InChI

InChI=1S/C15H23ClN4O3S/c1-4-5-24-14-19-12(16)9(17)13(20-14)18-7-6-8(21)11-10(7)22-15(2,3)23-11/h7-8,10-11,21H,4-6,17H2,1-3H3,(H,18,19,20)/t7-,8+,10+,11-/m1/s1/i1D3,4D2,5D2

IUPAC

(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(1,1,2,2,3,3,3-heptadeuteriopropylsulfanyl)pyrimidin-4-yl]amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat