(+)-cis-Diltiazem-d3 HCl (acetoxy-d3)

Analyte Name

(+)-cis-Diltiazem-d3 HCl (acetoxy-d3)

CAS Number

1217860-13-3

Molecular Formula

C22 D3 H23 N2 O4 S . Cl H

Molecular Weight

453.9973

Accurate Mass

453.1568

SMILES

Cl.[2H]C([2H])([2H])C(=O)O[C@@H]1[C@@H](Sc2ccccc2N(CCN(C)C)C1=O)c3ccc(OC)cc3

InChI

InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H/t20-,21+;/m1./s1/i1D3;

IUPAC

[(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] 2,2,2-trideuterioacetate;hydrochloride

Unlabelled CAS Number

33286-22-5

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)