7-Chlorothiokynurenic acid

CAS Registry Number®

135025-56-8
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CAS Name

7-Chlorothiokynurenic acid

Molecular Formula

C10H6ClNO2S

Molecular Mass

239.68

Cite this Page

7-Chlorothiokynurenic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=135025-56-8 (retrieved 2024-04-28) (CAS RN: 135025-56-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H6ClNO2S/c11-5-1-2-6-7(3-5)12-8(10(13)14)4-9(6)15/h1-4H,(H,12,15)(H,13,14)

InChIKey

InChIKey=KSCOHHUVHWAXLK-UHFFFAOYSA-N

SMILES

SC=1C2=C(N=C(C(O)=O)C1)C=C(Cl)C=C2

Canonical SMILES

O=C(O)C=1N=C2C=C(Cl)C=CC2=C(S)C1

Other Names for this Substance

  • 2-Quinolinecarboxylic acid, 7-chloro-4-mercapto-
  • 7-Chloro-4-mercapto-2-quinolinecarboxylic acid
  • 7-Chlorothiokynurenic acid

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