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Substance Name: Imidazole, 1-(3,4,5-trimethoxythiobenzoyl)-
RN: 70733-76-5
InChIKey: KBSZYTVMBUCYHD-UHFFFAOYSA-N

Molecular Formula

  • C13-H14-N2-O3-S

Molecular Weight

  • 278.3306
 
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Names and Synonyms

Synonyms

  • 1-(3,4,5-Trimethoxythiobenzoyl)imidazole
  • 5-23-04-00254 (Beilstein Handbook Reference)
  • BRN 0925628

Systematic Name

  • Imidazole, 1-(3,4,5-trimethoxythiobenzoyl)-

Registry Numbers

CAS Registry Number

  • 70733-76-5

System Generated Number

  • 0070733765

Structure Descriptors

InChI

1S/C13H14N2O3S/c1-16-10-6-9(7-11(17-2)12(10)18-3)13(19)15-5-4-14-8-15/h4-8H,1-3H3

InChIKey

KBSZYTVMBUCYHD-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)C(=S)n2ccnc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 50mg/kg (50mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 27, 1979.