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Substance Name: Acetamide, 2-((1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)thio)-
RN: 77952-74-0
InChIKey: LCKFZDKHJUUFKH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-N4-O3-S

Molecular Weight

  • 306.345
 
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Names and Synonyms

Synonyms

  • 2-((1-Benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)thio)acetamide
  • BRN 5119255

Systematic Name

  • Acetamide, 2-((1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)thio)-

Registry Numbers

CAS Registry Number

  • 77952-74-0

System Generated Number

  • 0077952740

Structure Descriptors

InChI

1S/C13H14N4O3S/c1-9-15-12(17(19)20)13(21-8-11(14)18)16(9)7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H2,14,18)

InChIKey

LCKFZDKHJUUFKH-UHFFFAOYSA-N

Smiles

c1(n(c(C)nc1[N+](=O)[O-])Cc1ccccc1)SCC(N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1240mg/kg (1240mg/kg)   Pharmaceutical Chemistry Journal Vol. 15, Pg. 97, 1981.