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Substance Name: Nicotinic acid, 2-(p-(p-chlorophenylthio)anilino)-, sodium salt
RN: 101952-57-2
InChIKey: NYWLMXNGIFPPMJ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H12-Cl-N2-O2-S.Na

Molecular Weight

  • 378.8138
 
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Names and Synonyms

Synonyms

  • 2-(p-(p-Chlorophenylthio)anilino)nicotinic acid sodium salt
  • Acide ((chloro-4 phenylthio)-4 phenylamino)-2 nicotinique
  • Acide ((chloro-4 phenylthio)-4 phenylamino)-2 nicotinique [French]

Systematic Name

  • Nicotinic acid, 2-(p-(p-chlorophenylthio)anilino)-, sodium salt

Registry Numbers

CAS Registry Number

  • 101952-57-2

System Generated Number

  • 0101952572

Molecular Formulas

Molecular Formula

  • C18-H12-Cl-N2-O2-S.Na

Molecular Formula Fragments

  • C18-H12-Cl-N2-O2-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C18H13ClN2O2S.Na/c19-12-3-7-14(8-4-12)24-15-9-5-13(6-10-15)21-17-16(18(22)23)2-1-11-20-17;/h1-11H,(H,20,21)(H,22,23);/q;+1/p-1

InChIKey

NYWLMXNGIFPPMJ-UHFFFAOYSA-M

Smiles

c1cc(c(nc1)Nc2ccc(cc2)Sc3ccc(cc3)Cl)C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 95mg/kg (95mg/kg)   Annales Pharmaceutiques Francaises. Vol. 38, Pg. 243, 1980.