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Substance Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(5-bromo-3-phenyl-1H-indol-2-yl)-4-phenyl-
RN: 126016-45-3
InChIKey: NYXQBBQUOJHAMQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H15-Br-N4-S

Molecular Weight

  • 447.3585
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-5-(5-bromo-3-phenyl-1H-indol-2-yl)-4-phenyl-3H-1,2,4-triazole-3-thione
  • BRN 4577703

Systematic Name

  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(5-bromo-3-phenyl-1H-indol-2-yl)-4-phenyl-

Registry Numbers

CAS Registry Number

  • 126016-45-3

System Generated Number

  • 0126016453

Structure Descriptors

InChI

1S/C22H15BrN4S/c23-15-11-12-18-17(13-15)19(14-7-3-1-4-8-14)20(24-18)21-25-26-22(28)27(21)16-9-5-2-6-10-16/h1-13,24H,(H,26,28)

InChIKey

NYXQBBQUOJHAMQ-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2c3cc(ccc3[nH]c2c4n[nH]c(=S)n4c5ccccc5)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg)   Indian Drugs. Vol. 29, Pg. 616, 1992.