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Substance Name: Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- (9CI)
RN: 20404-97-1
InChIKey: FEYDRETXYFWGJR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N2-O3-S

Molecular Weight

  • 330.406
 
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Names and Synonyms

Synonyms

  • 4'-(2-Nitro-1-(p-tolylthio)ethyl)acetanilide
  • BRN 2770031
  • U-3243

Systematic Names

  • Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- (9CI)
  • Acetanilide, 4'-(2-nitro-1-(p-tolylthio)ethyl)-

Registry Numbers

CAS Registry Number

  • 20404-97-1

System Generated Number

  • 0020404971

Structure Descriptors

InChI

1S/C17H18N2O3S/c1-12-3-9-16(10-4-12)23-17(11-19(21)22)14-5-7-15(8-6-14)18-13(2)20/h3-10,17H,11H2,1-2H3,(H,18,20)

InChIKey

FEYDRETXYFWGJR-UHFFFAOYSA-N

Smiles

c1([C@@H](Sc2ccc(C)cc2)C[N+](=O)[O-])ccc(NC(C)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 234mg/kg (234mg/kg)   Toxicology and Applied Pharmacology. Vol. 14, Pg. 89, 1969.
rat LD50 oral > 8gm/kg (8000mg/kg)   Toxicology and Applied Pharmacology. Vol. 14, Pg. 89, 1969.