Products 86408-42-6

CAS 86408-42-6 appears in our catalog under these names: Diltiazem Impurity 8, Deacetyl-N,O-didemethyldiltiazem. Offered by: Chemat Brand, TRC, Biosynth. Available pack sizes: on request, 250mg, 500mg.

Diltiazem Impurity 8
Chemat Brand
  • size: on request
  • Variants: 1
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Deacetyl-N,O-didemethyldiltiazem
TRC, Biosynth
  • size: 250mg, 500mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

(2S,3S)-3-hydroxy-2-(4-hydroxyphenyl)-5-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one (CAS 86408-42-6) is a chemical compound with the molecular formula C18H20N2O3S and a molecular weight of 344.4 g/mol. IUPAC name: (2S,3S)-3-hydroxy-2-(4-hydroxyphenyl)-5-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one. InChIKey: ZTRZZXJIQHVVGS-SJORKVTESA-N.

Identity
Molecular formulaC18H20N2O3S
Molecular weight344.4 g/mol
IUPAC name(2S,3S)-3-hydroxy-2-(4-hydroxyphenyl)-5-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one
InChIKeyZTRZZXJIQHVVGS-SJORKVTESA-N
SMILESCNCCN1C2=CC=CC=C2S[C@H]([C@H](C1=O)O)C3=CC=C(C=C3)O

Computed by PubChem (NCBI)

Synonyms: Deacetyl-N,O-didemethyldiltiazem, N,O-Didemethyldeacetyldiltiazem, o-Desmethyldeacetylnordiltiazem, Deacetyl-N,O-didesmethyldiltiazem, Desacetyl N,O-didesmethyl diltiazem, orb1986216, Desacetyl-N,O-didesmethyldiltiazem
Isomers (same molecular formula)
ethyl 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylate C18H20N2O3S
ethyl 2-(4-butoxy-3-cyanophenyl)-4-methyl-1,3-thiazole-5-carboxylate C18H20N2O3S
ethyl 2-(4-butan-2-yloxy-3-cyanophenyl)-4-methyl-1,3-thiazole-5-carboxylate C18H20N2O3S