CHEBI:133554 - thiocyclam hydrochloride

ChEBI IDCHEBI:133554
ChEBI Namethiocyclam hydrochloride
Stars
DefinitionA hydrochloride salt resulting from the formal reaction of equimolar amounts of thiocyclam and hydrogen chloride. A nicotinic acetylcholine receptor agonist used as a broad-spectrum insecticide. Not approved for use within the European Union.
Last Modified25 September 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC5H11NS3.HCl
Net Charge0
Average Mass217.812
Monoisotopic Mass216.98204
SMILESCN(C)C1CSSSC1.Cl
InChIInChI=1S/C5H11NS3.ClH/c1-6(2)5-3-7-9-8-4-5;/h5H,3-4H2,1-2H3;1H
InChIKeyDYLDNPYVDMQCFR-UHFFFAOYSA-N
Roles Classification
Biological Role:
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
insecticide  Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
ChEBI Ontology
Outgoing Relation(s)
thiocyclam hydrochloride (CHEBI:133554) has part thiocyclam(1+) (CHEBI:133552)
thiocyclam hydrochloride (CHEBI:133554) has role agrochemical (CHEBI:33286)
thiocyclam hydrochloride (CHEBI:133554) has role insecticide (CHEBI:24852)
thiocyclam hydrochloride (CHEBI:133554) has role nicotinic acetylcholine receptor agonist (CHEBI:47958)
thiocyclam hydrochloride (CHEBI:133554) is a hydrochloride (CHEBI:36807)
IUPAC Names 
N,N-dimethyl-1,2,3-trithian-5-amine hydrochloride
N,N-dimethyl-1,2,3-trithian-5-aminium chloride
Synonyms  Source
trithialanAlan Wood's Pesticides
N,N-dimethyl-1,2,3-trithian-5-amine hydrochloride (1:1)Alan Wood's Pesticides
thiocyclam.HClChEBI
thiocyclam HClChEBI
Manual XrefsDatabases
derivatives/thiocyclam%20hydrochlorideAlan Wood's Pesticides
Registry NumbersSources
Reaxys:32828398Reaxys
CAS:75655-75-3Alan Wood's Pesticides