Deacetyldiltiazem

CAS Registry Number®

42399-40-6
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CAS Name

Deacetyldiltiazem

Molecular Formula

C20H24N2O3S

Molecular Mass

372.48

Cite this Page

Deacetyldiltiazem.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42399-40-6 (retrieved 2024-05-02) (CAS RN: 42399-40-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    86-87 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

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

InChIKey=NZHUXMZTSSZXSB-MOPGFXCFSA-N

SMILES

C(CN(C)C)N1C=2C(S[C@H]([C@@H](O)C1=O)C3=CC=C(OC)C=C3)=CC=CC2

Canonical SMILES

O=C1N(C=2C=CC=CC2SC(C3=CC=C(OC)C=C3)C1O)CCN(C)C

Other Names for this Substance

  • 1,5-Benzothiazepin-4(5H)-one, 5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S,3S)-
  • 1,5-Benzothiazepin-4(5H)-one, 5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S-cis)-
  • (2S,3S)-5-[2-(Dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
  • Desacetyldiltiazem
  • Deacetyldiltiazem

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Deleted or Replaced CAS Registry Numbers

91602-22-1

CAS INSIGHTSTM
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