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Substance Name: Methanethiol, N-(p-methoxybenzyl)amidino-, hydrogen thiosulfate
RN: 40283-93-0
InChIKey: OKZCLMVQKVNQTO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H14-N2-O4-S2

Molecular Weight

  • 290.363
 
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Names and Synonyms

Synonyms

  • NSC 187551
  • S-((N-(p-Methoxybenzyl)amidino)methyl) hydrogen thiosulfate

Systematic Names

  • Methanethiol, N-(p-methoxybenzyl)amidino-, hydrogen thiosulfate
  • Thiosulfuric acid (H2S2O3), S-(2-imino-2-(((4-methoxyphenyl)methyl)amino)ethyl) ester (9CI)

Registry Numbers

CAS Registry Number

  • 40283-93-0

System Generated Number

  • 0040283930

Structure Descriptors

InChI

1S/C10H14N2O4S2/c1-16-9-4-2-8(3-5-9)6-12-10(11)7-17-18(13,14)15/h2-5H,6-7H2,1H3,(H2,11,12)(H,13,14,15)

InChIKey

OKZCLMVQKVNQTO-UHFFFAOYSA-N

Smiles

S(SCC(=N)NCc1ccc(cc1)OC)(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 87mg/kg (87mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.