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Substance Name: Benzoic acid, 3-amino-4-(methylamino)-5-((methylamino)sulfonyl)-
RN: 72020-13-4
InChIKey: URVCNIOSCXKICQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H13-N3-O4-S

Molecular Weight

  • 259.2847
 
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Names and Synonyms

Synonyms

  • 3-Amino-4-(methylamino)-5-((methylamino)sulfonyl)benzoic acid
  • BRN 2150067

Systematic Name

  • Benzoic acid, 3-amino-4-(methylamino)-5-((methylamino)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 72020-13-4

System Generated Number

  • 0072020134

Structure Descriptors

InChI

1S/C9H13N3O4S/c1-11-8-6(10)3-5(9(13)14)4-7(8)17(15,16)12-2/h3-4,11-12H,10H2,1-2H3,(H,13,14)

InChIKey

URVCNIOSCXKICQ-UHFFFAOYSA-N

Smiles

CNc1c(cc(cc1S(=O)(=O)NC)C(=O)O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 18, Pg. 88, 1979.