Zofenopril calcium

CAS Registry Number®

81938-43-4

CAS Name

Zofenopril calcium

Molecular Formula

C22H23NO4S2.1/2Ca

Cite this Page

Zofenopril calcium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81938-43-4 (retrieved 2024-11-25) (CAS RN: 81938-43-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H23NO4S2.Ca/c1-15(14-28-22(27)16-8-4-2-5-9-16)20(24)23-13-18(12-19(23)21(25)26)29-17-10-6-3-7-11-17;/h2-11,15,18-19H,12-14H2,1H3,(H,25,26);/t15-,18+,19+;/m1./s1

InChIKey

InChIKey=ITYYOFPEROWRNL-BQBHMPFISA-N

SMILES

C([C@@H](CSC(=O)C1=CC=CC=C1)C)(=O)N2[C@H](C(O)=O)C[C@H](SC3=CC=CC=C3)C2.[Ca]

Canonical SMILES

[Ca].O=C(SCC(C(=O)N1CC(SC=2C=CC=CC2)CC1C(=O)O)C)C=3C=CC=CC3

Other Names for this Substance

  • L-Proline, 1-[(2S)-3-(benzoylthio)-2-methyl-1-oxopropyl]-4-(phenylthio)-, calcium salt (2:1), (4S)-
  • L-Proline, 1-[3-(benzoylthio)-2-methyl-1-oxopropyl]-4-(phenylthio)-, calcium salt, [1(R*),2α,4α]-
  • Zofenopril calcium
  • SQ 26991
  • Zoprace

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