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Substance Name: Methanethiol, N-(6-hydroxyhexyl)amidino-, hydrogen thiosulfate
RN: 40283-79-2
InChIKey: SDOHGYUYKZFOOW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H18-N2-O4-S2

Molecular Weight

  • 270.3722
 
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Names and Synonyms

Synonym

  • S-((N-6-Hydroxyhexylamidino)methyl) hydrogen thiosulfate

Systematic Name

  • Methanethiol, N-(6-hydroxyhexyl)amidino-, hydrogen thiosulfate

Registry Numbers

CAS Registry Number

  • 40283-79-2

System Generated Number

  • 0040283792

Structure Descriptors

InChI

1S/C8H18N2O4S2/c9-8(7-15-16(12,13)14)10-5-3-1-2-4-6-11/h11H,1-7H2,(H2,9,10)(H,12,13,14)

InChIKey

SDOHGYUYKZFOOW-UHFFFAOYSA-N

Smiles

C(CCCO)CCNC(=N)CSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.
mouse LD50 oral 900mg/kg (900mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.