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Substance Name: Methanethiol, N-(3-(2-bornyloxy)propyl)amidino-, hydrogen sulfate (ester)
RN: 40283-85-0
InChIKey: TZWBNVVTNBUDMU-AVERBVTBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H28-N2-O4-S2

Molecular Weight

  • 364.5282
 
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Names and Synonyms

Synonym

  • S-((N-(3-(2-Bornyloxy)propyl)amidino)methyl) hydrogen thiosulfate

Systematic Name

  • Methanethiol, N-(3-(2-bornyloxy)propyl)amidino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 40283-85-0

System Generated Number

  • 0040283850

Structure Descriptors

InChI

1S/C15H28N2O4S2/c1-14(2)11-5-6-15(14,3)12(9-11)20-8-4-7-17-13(16)10-21-23(18,19)22/h11-12H,4-10H2,1-3H3,(H2,16,17)(H,18,19,22)/t11?,12-,15?/m0/s1

InChIKey

TZWBNVVTNBUDMU-AVERBVTBSA-N

Smiles

CC1(C2CCC1([C@H](C2)OCCCNC(=N)COS(=O)(=S)O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 19mg/kg (19mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1313, 1972.