Analyte Name

Ethyl N-(3-Chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)-amino-propanoate-d4

Molecular Formula

C19 D4 H17 Cl N2 O4 S

Molecular Weight

412.924

Accurate Mass

412.116

SMILES

[2H]C([2H])(NC1c2ccccc2N(C)S(=O)(=O)c3cc(Cl)ccc13)C([2H])([2H])C(=O)OCC

InChI

InChI=1S/C19H21ClN2O4S/c1-3-26-18(23)10-11-21-19-14-6-4-5-7-16(14)22(2)27(24,25)17-12-13(20)8-9-15(17)19/h4-9,12,19,21H,3,10-11H2,1-2H3/i10D2,11D2

IUPAC

ethyl 3-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][1,2]benzothiazepin-11-yl)amino]-2,2,3,3-tetradeuteriopropanoate

Unlabelled CAS Number

2089123-71-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat