Products 40601-99-8

CAS 40601-99-8 is the registry number for rac-cis-Desacetyl Diltiazem Hydrochloride. Offered by: TRC. Available pack sizes: 100mg.

rac-cis-Desacetyl Diltiazem Hydrochloride
TRC
  • size: 100mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

(2R,3R)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride (CAS 40601-99-8) is a chemical compound with the molecular formula C20H25ClN2O3S and a molecular weight of 408.9 g/mol. IUPAC name: (2R,3R)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride. InChIKey: XNQWAVFYFJXSHD-GRTNUQQKSA-N.

Identity
Molecular formulaC20H25ClN2O3S
Molecular weight408.9 g/mol
IUPAC name(2R,3R)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride
InChIKeyXNQWAVFYFJXSHD-GRTNUQQKSA-N
SMILESCN(C)CCN1C2=CC=CC=C2S[C@@H]([C@@H](C1=O)O)C3=CC=C(C=C3)OC.Cl

Computed by PubChem (NCBI)

Related forms of this compound
(2S,3S)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one;hydrochloride C20H25ClN2O3S
Isomers (same molecular formula)
2-(dimethylamino)-5-ethyl-3-hydroxy-2-(4-methoxyphenyl)-3H-1,5-benzothiazepin-4-one;hydrochloride C20H25ClN2O3S