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CHEBI:77092 - fenbendazole

ChEBI IDCHEBI:77092
ChEBI Namefenbendazole
Stars
DefinitionA member of the class of benzimidazoles that is 1H-benzimidazole which is substituted at positons 2 and 5 by (methoxycarbonyl)amino and phenylsulfanediyl groups, respectively. A broad-spectrum anthelmintic, it is used, particularly in veterinary medicine, for the treatment of nematodal infections.
Last Modified26 February 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H13N3O2S
Net Charge0
Average Mass299.355
Monoisotopic Mass299.07285
SMILESCOC(=O)Nc1nc2ccc(Sc3ccccc3)cc2n1
InChIInChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
InChIKeyHDDSHPAODJUKPD-UHFFFAOYSA-N
Wikipedia
Roles Classification
Application:
antinematodal drug  A substance used in the treatment or control of nematode infestations.
ChEBI Ontology
Outgoing Relation(s)
fenbendazole (CHEBI:77092) has role antinematodal drug (CHEBI:35444)
fenbendazole (CHEBI:77092) is a aryl sulfide (CHEBI:35683)
fenbendazole (CHEBI:77092) is a benzimidazoles (CHEBI:22715)
fenbendazole (CHEBI:77092) is a carbamate ester (CHEBI:23003)
Incoming Relation(s)
hydroxyfenbendazole (CHEBI:140184) has functional parent fenbendazole (CHEBI:77092)
oxfendazole (CHEBI:35812) has functional parent fenbendazole (CHEBI:77092)
IUPAC Name 
methyl [5-(phenylsulfanyl)-1H-benzimidazol-2-yl]carbamate
INNs  Source
fenbendazolumWHO MedNet
fenbendazoleWHO MedNet
fenbendazoleWHO MedNet
fenbendazolWHO MedNet
Synonyms  Source
2-(methoxycarbonylamino)-5-(phenylthio)benzimidazoleChemIDplus
Hoe 881vChemIDplus
methyl [5-(phenylthio)-1H-benzimidazol-2-yl]carbamateChemIDplus
methyl 5-(phenylthio)-2-benzimidazolecarbamateChemIDplus
5-(phenylthio)-2-benzimidazolecarbamic acid methyl esterChEBI
[5-(phenylthio)-1H-benzimidazol-2-yl]carbamic acid methyl esterChEBI
Brand Names  Source
PanacurChemIDplus
Safe-quardChemIDplus
UniProt Name  Source
fenbendazoleUniProt
Manual XrefsDatabases
D04140KEGG DRUG
FenbendazoleWikipedia
HMDB0029745HMDB
DE2164690Patent
US3954791Patent
LSM-3134LINCS
4536DrugCentral
1758VSDB
Registry NumbersSources
Reaxys:759077Reaxys
CAS:43210-67-9ChemIDplus
Citations