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Substance Name: 2-(Acetoacetamido)benzothiazole
RN: 4692-94-8
UNII: 6LYP4R9QY6
InChIKey: KRVAVIMTIIEASB-UHFFFAOYSA-N

Molecular Formula

  • C11-H10-N2-O2-S

Molecular Weight

  • 234.278
 
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Names and Synonyms

Name of Substance

  • 2-(Acetoacetamido)benzothiazole

Synonyms

  • 2-(Acetoacetamido)benzothiazole
  • 4-27-00-04845 (Beilstein Handbook Reference)
  • Acetoacetamide, N-(2-benzothiazolyl)-
  • BRN 0202998
  • N-(2-Benzothiazolyl)-acetoacetamide
  • NSC 86136
  • UNII-6LYP4R9QY6

Systematic Names

  • Acetoacetamide, N-(2-benzothiazolyl)-
  • Butanamide, N-2-benzothiazolyl-3-oxo- (9CI)

Registry Numbers

CAS Registry Number

  • 4692-94-8

FDA UNII

  • 6LYP4R9QY6

System Generated Number

  • 0004692948

Structure Descriptors

InChI

1S/C11H10N2O2S/c1-7(14)6-10(15)13-11-12-8-4-2-3-5-9(8)16-11/h2-5H,6H2,1H3,(H,12,13,15)

InChIKey

KRVAVIMTIIEASB-UHFFFAOYSA-N

Smiles

c12c(sc(n1)NC(CC(C)=O)=O)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02307,