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Substance Name: Thiosulfuric acid, S-(2-(((3-(4-bromophenyl)tricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester
RN: 155622-15-4
InChIKey: HNOGSWOJWKMFRG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H25-Br-N2-O3-S2

Molecular Weight

  • 473.4535
 
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Names and Synonyms

Synonym

  • N-(3-(4-Bromophenyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid

Systematic Name

  • Thiosulfuric acid, S-(2-(((3-(4-bromophenyl)tricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester

Registry Numbers

CAS Registry Number

  • 155622-15-4

System Generated Number

  • 0155622154

Structure Descriptors

InChI

1S/C19H25BrN2O3S2/c20-16-3-1-15(2-4-16)19-8-13-5-14(9-19)7-18(6-13,11-19)12-22-17(21)10-26-27(23,24)25/h1-4,13-14H,5-12H2,(H2,21,22)(H,23,24,25)

InChIKey

HNOGSWOJWKMFRG-UHFFFAOYSA-N

Smiles

c1cc(ccc1C23CC4CC(C2)CC(C4)(C3)CNC(=N)CSS(=O)(=O)O)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 23mg/kg (23mg/kg)   Pharmaceutical Chemistry Journal Vol. 27, Pg. 585, 1993.