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Substance Name: Isothiazole-4-carboxaldehyde, 3-methyl-, thiosemicarbazone
RN: 3683-57-6
InChIKey: MWMGFPVLBLRWMJ-KRXBUXKQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H8-N4-S2

Molecular Weight

  • 200.289
 
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Names and Synonyms

Synonyms

  • 1-(3-Methyl-4-isothiazolyl)methylenethiosemicarbazide
  • 3-Methylisothiazole-4-carboxaldehyde thiosemicarbazone
  • BRN 0515833
  • Thiosemicarbazide, 1-(3-methyl-4-isothiazolyl)methylene-

Systematic Name

  • Isothiazole-4-carboxaldehyde, 3-methyl-, thiosemicarbazone

Registry Numbers

CAS Registry Number

  • 3683-57-6

System Generated Number

  • 0003683576

Structure Descriptors

InChI

1S/C6H8N4S2/c1-4-5(3-12-10-4)2-8-9-6(7)11/h2-3H,1H3,(H3,7,9,11)/b8-2+

InChIKey

MWMGFPVLBLRWMJ-KRXBUXKQSA-N

Smiles

c1(c(nsc1)C)\C=N\NC(N)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 680, 1965.