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Substance Name: Disalazine
RN: 146404-38-8
InChIKey: ASLYKDBHQZVPHW-OCOZRVBESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-N5-O6-S

Molecular Weight

  • 469.4761
 
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Names and Synonyms

Results Name

  • Disalazine

Synonyms

  • 2-(Acetyloxy)-5-((4-(((4,6-dimethyl-2-pyrimidinyl)amino)sulfonyl)phenyl)azo)benzoic acid
  • 2-Acetoxy-5-(4-(N-(4,6-dimethyl-2-pyrimidinyl)sulfamoyl)phenylazo)benzoic acid
  • Disalazine
  • VUFB-17259

Systematic Name

  • Benzoic acid, 2-(acetyloxy)-5-((4-(((4,6-dimethyl-2-pyrimidinyl)amino)sulfonyl)phenyl)azo)-

Registry Numbers

CAS Registry Number

  • 146404-38-8

System Generated Number

  • 0146404388

Structure Descriptors

InChI

1S/C21H19N5O6S/c1-12-10-13(2)23-21(22-12)26-33(30,31)17-7-4-15(5-8-17)24-25-16-6-9-19(32-14(3)27)18(11-16)20(28)29/h4-11H,1-3H3,(H,28,29)(H,22,23,26)/b25-24+

InChIKey

ASLYKDBHQZVPHW-OCOZRVBESA-N

Smiles

Cc1cc(nc(n1)NS(=O)(=O)c2ccc(cc2)/N=N/c3ccc(c(c3)C(=O)O)OC(=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   Drugs of the Future. Vol. 17, Pg. 98, 1992.