Product Code

TRC-D665481

CAS Number

1609392-27-9

Product Format

Neat

Molecular Formula

C20 D3 H19 N8 O3

Molecular Weight

425.459

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled, Contaminant

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Deucravacitinib

CAS Number

1609392-27-9

Molecular Formula

C20 D3 H19 N8 O3

Molecular Weight

425.459

Accurate Mass

425.2

SMILES

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc3cccc(c3OC)c4ncn(C)n4

InChI

InChI=1S/C20H22N8O3/c1-21-20(30)16-14(9-15(25-26-16)24-19(29)11-7-8-11)23-13-6-4-5-12(17(13)31-3)18-22-10-28(2)27-18/h4-6,9-11H,7-8H2,1-3H3,(H,21,30)(H2,23,24,25,29)/i1D3

IUPAC

6-(cyclopropanecarbonylamino)-4-[2-methoxy-3-(1-methyl-1,2,4-triazol-3-yl)anilino]-N-(trideuteriomethyl)pyridazine-3-carboxamide

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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