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Substance Name: Phenol, 2-(5-(methylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-
RN: 81518-33-4
InChIKey: NFEPEHYQTDIYCQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H13-N3-O-S

Molecular Weight

  • 283.3537
 
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Names and Synonyms

Synonyms

  • 2-(5-(Methylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)phenol
  • BRN 5073358

Systematic Name

  • Phenol, 2-(5-(methylthio)-4-phenyl-4H-1,2,4-triazol-3-yl)-

Registry Numbers

CAS Registry Number

  • 81518-33-4

System Generated Number

  • 0081518334

Structure Descriptors

InChI

1S/C15H13N3OS/c1-20-15-17-16-14(12-9-5-6-10-13(12)19)18(15)11-7-3-2-4-8-11/h2-10,19H,1H3

InChIKey

NFEPEHYQTDIYCQ-UHFFFAOYSA-N

Smiles

CSc1nnc(n1c2ccccc2)c3ccccc3O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 20, Pg. 1017, 1981.