CHEBI:77092 - fenbendazole

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ChEBI Name fenbendazole ChEBI ID CHEBI:77092 Definition A 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. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C15H13N3O2S Net Charge 0 Average Mass 299.34800 Monoisotopic Mass 299.07285 InChI InChI=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) InChIKey HDDSHPAODJUKPD-UHFFFAOYSA-N SMILES COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1 Roles Classification Application(s): antinematodal drug A substance used in the treatment or control of nematode infestations. View more via ChEBI Ontology ChEBI Ontology Outgoing 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 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 Sources fenbendazol WHO MedNet fenbendazole WHO MedNet fenbendazole WHO MedNet fenbendazolum WHO MedNet Synonyms Sources 2-(methoxycarbonylamino)-5-(phenylthio)benzimidazole ChemIDplus 5-(phenylthio)-2-benzimidazolecarbamic acid methyl ester ChEBI [5-(phenylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester ChEBI fenbendazole UniProt Hoe 881v ChemIDplus methyl 5-(phenylthio)-2-benzimidazolecarbamate ChemIDplus methyl [5-(phenylthio)-1H-benzimidazol-2-yl]carbamate ChemIDplus Brand Names Sources Panacur ChemIDplus Safe-quard ChemIDplus Manual Xrefs Databases 1758 VSDB 4536 DrugCentral D04140 KEGG DRUG DE2164690 Patent Fenbendazole Wikipedia HMDB0029745 HMDB LSM-3134 LINCS US3954791 Patent View more database links Registry Numbers Types Sources 43210-67-9 CAS Registry Number ChemIDplus 759077 Reaxys Registry Number Reaxys Citations Types Sources 22048645 PubMed citation Europe PMC 23488766 PubMed citation Europe PMC 23959307 PubMed citation Europe PMC 24183965 PubMed citation Europe PMC Last Modified 26 February 2018