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Substance Name: 1H-1,2,4-Triazole-3-thiol, 5-((p-ethylsulfonyl)phenyl)-
RN: 4922-58-1
InChIKey: MGQJKXDIJCHSHR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H11-N3-O2-S2

Molecular Weight

  • 269.348
 
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Names and Synonyms

Synonyms

  • 5-((p-Ethylsulfonyl)phenyl)-1H-1,2,4-triazole-3-thiol
  • BRN 2990864

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 4922-58-1

System Generated Number

  • 0004922581

Structure Descriptors

InChI

1S/C10H11N3O2S2/c1-2-17(14,15)8-5-3-7(4-6-8)9-11-10(16)13-12-9/h3-6H,2H2,1H3,(H2,11,12,13,16)

InChIKey

MGQJKXDIJCHSHR-UHFFFAOYSA-N

Smiles

[nH]1nc(nc1c1ccc(cc1)S(=O)(=O)CC)S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD05 intraperitoneal 1260mg/kg (1260mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 42, 1966.