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Substance Name: Hydrazinecarbothioamide, N-(2-methoxyphenyl)-2-(1-(2,3,4-trihydroxyphenyl)ethylidene)-
RN: 69326-87-0
InChIKey: WXXOKYYQZLODKP-NVMNQCDNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N3-O4-S

Molecular Weight

  • 347.3933
 
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Names and Synonyms

Synonyms

  • 4-(o-Methoxyphenyl)-1-(2,3,4-trihydroxyacetophenone)-3-thiosemicarbazone
  • Acetophenone, 2,3,4-trihydroxy-, 4-(o-methoxyphenyl)-3-thiosemicarbazone
  • N-(2-Methoxyphenyl)-2-(1-(2,3,4-trihydroxyphenyl)ethylidene)hydrazinecarbothioamide

Systematic Name

  • Hydrazinecarbothioamide, N-(2-methoxyphenyl)-2-(1-(2,3,4-trihydroxyphenyl)ethylidene)-

Registry Numbers

CAS Registry Number

  • 69326-87-0

System Generated Number

  • 0069326870

Structure Descriptors

InChI

1S/C16H17N3O4S/c1-9(10-7-8-12(20)15(22)14(10)21)18-19-16(24)17-11-5-3-4-6-13(11)23-2/h3-8,20-22H,1-2H3,(H2,17,19,24)/b18-9-

InChIKey

WXXOKYYQZLODKP-NVMNQCDNSA-N

Smiles

C/C(=N/NC(=S)Nc1ccccc1OC)/c2ccc(c(c2O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Research Communications in Chemical Pathology and Pharmacology. Vol. 22, Pg. 291, 1978.