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Substance Name: Ketone, hexyl(4-pyridyl), thiosemicarbazone
RN: 3608-80-8
InChIKey: VZAONYUZXAMGGS-VBKFSLOCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N4-S

Molecular Weight

  • 264.395
 
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Names and Synonyms

Synonyms

  • 5-21-07-00467 (Beilstein Handbook Reference)
  • BRN 1469852
  • n-Hexyl 4-pyridyl ketone thiosemicarbazone

Systematic Name

  • Ketone, hexyl(4-pyridyl), thiosemicarbazone

Registry Numbers

CAS Registry Number

  • 3608-80-8

System Generated Number

  • 0003608808

Structure Descriptors

InChI

1S/C13H20N4S/c1-2-3-4-5-6-12(16-17-13(14)18)11-7-9-15-10-8-11/h7-10H,2-6H2,1H3,(H3,14,17,18)/b16-12-

InChIKey

VZAONYUZXAMGGS-VBKFSLOCSA-N

Smiles

C(\c1ccncc1)(CCCCCC)=N/NC(N)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 676, 1965.