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Substance Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(1,3-benzodioxol-5-yloxy)ethyl)-
RN: 115398-72-6
InChIKey: HBCCYRFRENFZOF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-N4-O3-S

Molecular Weight

  • 280.3068
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-4-amino-5-(1-(1,3-benzodioxol-5-yloxy)ethyl)-3H-1,2,4-triazole-3-thione
  • BRN 5979043

Systematic Name

  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(1-(1,3-benzodioxol-5-yloxy)ethyl)-

Registry Numbers

CAS Registry Number

  • 115398-72-6

System Generated Number

  • 0115398726

Structure Descriptors

InChI

1S/C11H12N4O3S/c1-6(10-13-14-11(19)15(10)12)18-7-2-3-8-9(4-7)17-5-16-8/h2-4,6H,5,12H2,1H3,(H,14,19)

InChIKey

HBCCYRFRENFZOF-UHFFFAOYSA-N

Smiles

CC(c1n[nH]c(=S)n1N)Oc2ccc3c(c2)OCO3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Indian Drugs. Vol. 25, Pg. 301, 1988.