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Substance Name: Deacetyldiltiazem
RN: 42399-40-6
UNII: 849UT193YJ
InChIKey: NZHUXMZTSSZXSB-MOPGFXCFSA-N

Note

  • Metabolite of diltiazem.

Molecular Formula

  • C20-H24-N2-O3-S

Molecular Weight

  • 372.4866
 
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Names and Synonyms

Name of Substance

  • Deacetyldiltiazem

Synonyms

  • EINECS 255-795-9
  • UNII-849UT193YJ

Systematic Name

  • (2S-cis)-5-(2-(Dimethylamino)ethyl)-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one

Registry Numbers

CAS Registry Number

  • 42399-40-6

FDA UNII

  • 849UT193YJ

System Generated Number

  • 0042399406

Structure Descriptors

InChI

InChI=1S/C20H24N2O3S/c1-21(2)12-13-22-16-6-4-5-7-17(16)26-19(18(23)20(22)24)14-8-10-15(25-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3/t18-,19+/m1/s1

InChIKey

NZHUXMZTSSZXSB-MOPGFXCFSA-N

Smiles

COc1ccc(cc1)[C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2O