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CHEBI:8654 - pyrantel

ChEBI IDCHEBI:8654
ChEBI Namepyrantel
Stars
DefinitionA carboxamidine that is 1,4,5,6-tetrahydropyrimidine that is substituted at position 1 by a methyl group and at position 2 by an (E)-2-(2-thienyl)vinyl group. It is used, particularly as the embonate [4,4'-methylenebis(3-hydroxy-2-naphthoate)] salt, as an anthelmintic that is effective against intestinal nematodes including threadworms, roundworms and hookworms, and is included in the WHO 'Model List of Essential Medicines'.
Last Modified22 February 2017
DownloadsMolfile
FormulaC11H14N2S
Net Charge0
Average Mass206.314
Monoisotopic Mass206.08777
SMILESCN1CCCN=C1/C=C/c1cccs1
InChIInChI=1S/C11H14N2S/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10/h2,4-6,9H,3,7-8H2,1H3/b6-5+
InChIKeyYSAUAVHXTIETRK-AATRIKPKSA-N
Wikipedia
Roles Classification
Application:
antinematodal drug  A substance used in the treatment or control of nematode infestations.
ChEBI Ontology
Outgoing Relation(s)
pyrantel (CHEBI:8654) has role antinematodal drug (CHEBI:35444)
pyrantel (CHEBI:8654) is a 1,4,5,6-tetrahydropyrimidines (CHEBI:78715)
pyrantel (CHEBI:8654) is a carboxamidine (CHEBI:35359)
pyrantel (CHEBI:8654) is a thiophenes (CHEBI:26961)
IUPAC Name 
1-methyl-2-[(E)-2-(2-thienyl)vinyl]-1,4,5,6-tetrahydropyrimidine
INNs  Source
pyrantelumWHO MedNet
pyrantelWHO MedNet
pirantelWHO MedNet
pyrantelChemIDplus
Manual XrefsDatabases
C07409KEGG COMPOUND
D08451KEGG DRUG
BE658987Patent
US3502661Patent
PyrantelWikipedia
2999DrugCentral
Registry NumbersSources
Reaxys:518505Reaxys
CAS:15686-83-6KEGG COMPOUND
CAS:15686-83-6ChemIDplus
Citations