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Substance Name: Acetoacetic acid, 3-(thiosemicarbazone)
RN: 18465-43-5
InChIKey: OHJLLZVFYGLVJE-XVNBXDOJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H9-N3-O2-S

Molecular Weight

  • 175.211
 
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Names and Synonyms

Synonym

  • Thiosemicarbazone of acetylacetic acid

Systematic Name

  • Acetoacetic acid, 3-(thiosemicarbazone)

Registry Numbers

CAS Registry Number

  • 18465-43-5

System Generated Number

  • 0018465435

Structure Descriptors

InChI

1S/C5H9N3O2S/c1-3(2-4(9)10)7-8-5(6)11/h2H2,1H3,(H,9,10)(H3,6,8,11)/b7-3+

InChIKey

OHJLLZVFYGLVJE-XVNBXDOJSA-N

Smiles

C(=N\NC(N)=S)(\CC(O)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Archivum Immunologiae et Therapiae Experimentalis. Vol. 16, Pg. 676, 1968.