Temocapril hydrochloride

CAS Registry Number®

110221-44-8

CAS Name

Temocapril hydrochloride

Molecular Formula

C23H28N2O5S2.ClH

Cite this Page

Temocapril hydrochloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=110221-44-8 (retrieved 2024-11-23) (CAS RN: 110221-44-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    187 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C23H28N2O5S2.ClH/c1-2-30-23(29)17(11-10-16-7-4-3-5-8-16)24-18-15-32-20(19-9-6-12-31-19)13-25(22(18)28)14-21(26)27;/h3-9,12,17-18,20,24H,2,10-11,13-15H2,1H3,(H,26,27);1H/t17-,18-,20-;/m0./s1

InChIKey

InChIKey=XDDQNOKKZKHBIX-ASBZXGSUSA-N

SMILES

C(C(O)=O)N1C[C@H](SC[C@H](N[C@@H](CCC2=CC=CC=C2)C(OCC)=O)C1=O)C3=CC=CS3.Cl

Canonical SMILES

Cl.O=C(O)CN1C(=O)C(NC(C(=O)OCC)CCC=2C=CC=CC2)CSC(C=3SC=CC3)C1

Other Names for this Substance

  • 1,4-Thiazepine-4(5H)-acetic acid, 6-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]tetrahydro-5-oxo-2-(2-thienyl)-, hydrochloride (1:1), (2S,6R)-
  • 1,4-Thiazepine-4(5H)-acetic acid, 6-[[1-(ethoxycarbonyl)-3-phenylpropyl]amino]tetrahydro-5-oxo-2-(2-thienyl)-, monohydrochloride, [2S-[2α,6β(R*)]]-
  • 1,4-Thiazepine-4(5H)-acetic acid, 6-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]tetrahydro-5-oxo-2-(2-thienyl)-, monohydrochloride, (2S,6R)-
  • CS 622
  • Temocapril hydrochloride

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