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Substance Name: 1H-1,2,4-Triazole-3-thiol, 5-(p-ureidophenyl)-
RN: 3414-98-0
InChIKey: ZQYMUOLZXUSCAN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H9-N5-O-S

Molecular Weight

  • 235.27
 
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Names and Synonyms

Synonyms

  • 5-(p-Ureidophenyl)-1H-1,2,4-triazole-3-thiol
  • BRN 2985930
  • p-(3-Mercapto-s-triazol-5-yl)phenylurea
  • Urea, 1-(p-(3-mercapto-s-triazol-5-yl)phenyl)-

Systematic Name

  • 1H-1,2,4-Triazole-3-thiol, 5-(p-ureidophenyl)-

Registry Numbers

CAS Registry Number

  • 3414-98-0

System Generated Number

  • 0003414980

Structure Descriptors

InChI

1S/C9H9N5OS/c10-8(15)11-6-3-1-5(2-4-6)7-12-9(16)14-13-7/h1-4H,(H3,10,11,15)(H2,12,13,14,16)

InChIKey

ZQYMUOLZXUSCAN-UHFFFAOYSA-N

Smiles

N(C(=O)N)c1ccc(cc1)c1[nH][nH]c(n1)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD05 intraperitoneal 198mg/kg (198mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 42, 1966.