Spiraprilat

CAS Registry Number®

83602-05-5
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CAS Name

Spiraprilat

Molecular Formula

C20H26N2O5S2

Molecular Mass

438.56

Cite this Page

Spiraprilat.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83602-05-5 (retrieved 2024-04-27) (CAS RN: 83602-05-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    163-165 °C (decomp)

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C20H26N2O5S2/c1-13(21-15(18(24)25)8-7-14-5-3-2-4-6-14)17(23)22-12-20(28-9-10-29-20)11-16(22)19(26)27/h2-6,13,15-16,21H,7-12H2,1H3,(H,24,25)(H,26,27)/t13-,15-,16-/m0/s1

InChIKey

InChIKey=FMMDBLMCSDRUPA-BPUTZDHNSA-N

SMILES

C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C)(=O)N2CC3(C[C@H]2C(O)=O)SCCS3

Canonical SMILES

O=C(O)C(NC(C(=O)N1CC2(SCCS2)CC1C(=O)O)C)CCC=3C=CC=CC3

Other Names for this Substance

  • 1,4-Dithia-7-azaspiro[4.4]nonane-8-carboxylic acid, 7-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]-1-oxopropyl]-, (8S)-
  • 1,4-Dithia-7-azaspiro[4.4]nonane-8-carboxylic acid, 7-[2-[(1-carboxy-3-phenylpropyl)amino]-1-oxopropyl]-, [8S-[7[R*(R*)],8R*]]-
  • Sch 33861
  • Spiraprilic acid
  • Spiraprilat

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