Analyte Name

Iguratimod-d5

Molecular Formula

C17 D5 H9 N2 O6 S

Molecular Weight

379.399

Accurate Mass

379.089

SMILES

[2H]c1c([2H])c([2H])c(Oc2cc3C(=O)C(=COc3cc2NS(=O)(=O)C)NC=O)c([2H])c1[2H]

InChI

InChI=1S/C17H14N2O6S/c1-26(22,23)19-13-8-15-12(17(21)14(9-24-15)18-10-20)7-16(13)25-11-5-3-2-4-6-11/h2-10,19H,1H3,(H,18,20)/i2D,3D,4D,5D,6D

IUPAC

N-[7-(methanesulfonamido)-4-oxo-6-(2,3,4,5,6-pentadeuteriophenoxy)chromen-3-yl]formamide

Unlabelled CAS Number

123663-49-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat