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Substance Name: BRN 5681740
RN: 97399-39-8
InChIKey: RNBFEFHXZWQKRD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H18-Br2-Cl-N5-O3-S

Molecular Weight

  • 651.7652
 
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Names and Synonyms

Results Name

  • BRN 5681740

Synonym

  • BRN 5681740

Systematic Name

  • Acetamide, N-(((4-chlorophenyl)amino)carbonyl)-2-((5-(3,5-dibromo-2-hydroxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl)thio)-

Registry Numbers

CAS Registry Number

  • 97399-39-8

System Generated Number

  • 0097399398

Structure Descriptors

InChI

1S/C24H18Br2ClN5O3S/c1-13-2-8-17(9-3-13)32-22(18-10-14(25)11-19(26)21(18)34)30-31-24(32)36-12-20(33)29-23(35)28-16-6-4-15(27)5-7-16/h2-11,34H,12H2,1H3,(H2,28,29,33,35)

InChIKey

RNBFEFHXZWQKRD-UHFFFAOYSA-N

Smiles

c1(n(c(nn1)SCC(=O)NC(=O)Nc1ccc(Cl)cc1)c1ccc(cc1)C)c1c(c(cc(c1)Br)Br)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 190, 1985.