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Substance Name: Allocupreide sodium [INN:DCF]
RN: 5965-40-2
UNII: WKG854RBET
InChIKey: QKMGIVQNFXRKEE-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H10-N2-O2-S.Cu.Na

Molecular Weight

  • 320.814
 
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Names and Synonyms

Name of Substance

  • Allocupreide sodium [INN:DCF]

Synonyms

  • 3-(3-Allyl-S-cupropseudothioureido)benzoic acid sodium salt
  • Allocupreide sodique
  • Allocupreide sodique [INN-French]
  • Allocupreide sodium
  • Allocupreidum natricum
  • Allocupreidum natricum [INN-Latin]
  • Alocupreido sodico
  • Alocupreido sodico [INN-Spanish]
  • Benzoic acid, 3-(((2-propenylamino)thioxomethyl)amino)-, monocopper(1+), monosodium salt
  • Cu 101
  • Cupralene
  • Cupralyl sodium
  • Cupralylnatrium
  • Cuprelon
  • Cuprion
  • Cuprothiosinamine m-benzoate sodium
  • Ebesal
  • m-(((Allylamino)mercaptomethyl)amino)benzoic acid S-copper deriv. sodium salt
  • m-((N-Allyl-1-mercaptoformimidoyl)amino)benzoic acid copper deriv. sodium salt
  • Natrium 3-(3-allyl-2-cuproisothioureido)benzoate
  • Natrium allocupreid
  • Sodium 3-(3-allyl-S-cuproisothioureido)benzoate
  • Sodium 3-(3-allyl-S-cupropseudothioureido)benzoate
  • UNII-WKG854RBET

Systematic Names

  • Benzoic acid, m-((N-allyl-1-mercaptoformimidoyl)amino)-, monocopper(1+) monosodium salt
  • Sodium 3-(3-allyl-S-cupropseudothioureido)benzoate

Registry Numbers

CAS Registry Number

  • 5965-40-2

FDA UNII

  • WKG854RBET

System Generated Number

  • 0005965402

Molecular Formulas

Molecular Formula

  • C11-H10-N2-O2-S.Cu.Na

Molecular Formula Fragments

  • C11-H10-N2-O2-S
  • COMPONENT
  • Cu
  • Na

Structure Descriptors

InChI

1S/C11H12N2O2S.Cu.Na/c1-2-6-12-11(16)13-9-5-3-4-8(7-9)10(14)15;;/h2-5,7H,1,6H2,(H,14,15)(H2,12,13,16);;/q;2*+1/p-2

InChIKey

QKMGIVQNFXRKEE-UHFFFAOYSA-L

Smiles

c1ccc(N\C(S[Cu])=N\CC=C)cc1C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intramuscular 375mg/kg (375mg/kg)   Annals of the Rheumatic Diseases. Vol. 10, Pg. 328, 1951.
rat LD50 intraperitoneal 160mg/kg (160mg/kg)   Annals of the Rheumatic Diseases. Vol. 10, Pg. 328, 1951.