Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methanethiol, N-(p-methoxyphenethyl)amidino-, hydrogen thiosulfate
RN: 40283-94-1
InChIKey: VPTIXDOSBAIVCW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O4-S2

Molecular Weight

  • 304.3894
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • S-((N-(p-Methoxyphenethyl)amidino)methyl) hydrogen thiosulfate

Systematic Name

  • Methanethiol, N-(p-methoxyphenethyl)amidino-, hydrogen thiosulfate

Registry Numbers

CAS Registry Number

  • 40283-94-1

System Generated Number

  • 0040283941

Structure Descriptors

InChI

1S/C11H16N2O4S2/c1-17-10-4-2-9(3-5-10)6-7-13-11(12)8-18-19(14,15)16/h2-5H,6-8H2,1H3,(H2,12,13)(H,14,15,16)

InChIKey

VPTIXDOSBAIVCW-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)CCNC(=N)CSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.
mouse LD50 oral 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.