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Substance Name: 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-
RN: 108132-86-1
InChIKey: OXFSRFXBMWZEBK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N3-O4

Molecular Weight

  • 265.2675
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-3H-1,2,4-triazol-3-one
  • BRN 5981593

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 108132-86-1

System Generated Number

  • 0108132861

Structure Descriptors

InChI

1S/C12H15N3O4/c1-4-19-10-8(17-2)5-7(6-9(10)18-3)11-13-12(16)15-14-11/h5-6H,4H2,1-3H3,(H2,13,14,15,16)

InChIKey

OXFSRFXBMWZEBK-UHFFFAOYSA-N

Smiles

CCOc1c(cc(cc1OC)c2[nH][nH]c(=O)n2)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 400mg/kg (400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.
mammal (species unspecified) LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.