Analyte Name

N-((4-(2-(((3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl)amino)ethyl)phenyl)sulfonyl)carbamic Acid Methyl Ester-d5

CAS Number

1028809-96-2

Molecular Formula

C18 D5 H18 N3 O6 S

Molecular Weight

414.488

Accurate Mass

414.162

SMILES

[2H]C([2H])([2H])C([2H])([2H])C1=C(C)CN(C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)OC)C1=O

InChI

InChI=1S/C18H23N3O6S/c1-4-15-12(2)11-21(16(15)22)17(23)19-10-9-13-5-7-14(8-6-13)28(25,26)20-18(24)27-3/h5-8H,4,9-11H2,1-3H3,(H,19,23)(H,20,24)/i1D3,4D2

IUPAC

methyl N-[4-[2-[[3-methyl-5-oxo-4-(1,1,2,2,2-pentadeuterioethyl)-2H-pyrrole-1-carbonyl]amino]ethyl]phenyl]sulfonylcarbamate

Unlabelled CAS Number

119018-30-3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity; Stable Isotope Labelled; API

Product Format

Neat