EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:45979 - thiabendazole

ChEBI IDCHEBI:45979
ChEBI Namethiabendazole
Stars
DefinitionA member of the class of benzimidazoles carrying a 1,3-thiazol-4-yl substituent at position 2. A mainly post-harvest fungicide used to control a wide range of diseases including Aspergillus, Botrytis, Cladosporium and Fusarium.
Secondary ChEBI IDsCHEBI:9526, CHEBI:45977
Last Modified22 February 2017
DownloadsMolfile
FormulaC10H7N3S
Net Charge0
Average Mass201.254
Monoisotopic Mass201.03607
SMILESc1ccc2nc(-c3cscn3)nc2c1
InChIInChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)
InChIKeyWJCNZQLZVWNLKY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide  A substance used to destroy fungal pests.
Applications:
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
antinematodal drug  A substance used in the treatment or control of nematode infestations.
fungicide  A substance used to destroy fungal pests.
ChEBI Ontology
Outgoing Relation(s)
thiabendazole (CHEBI:45979) has parent hydride 1H-benzimidazole (CHEBI:41275)
thiabendazole (CHEBI:45979) has role antifungal agrochemical (CHEBI:86328)
thiabendazole (CHEBI:45979) has role antinematodal drug (CHEBI:35444)
thiabendazole (CHEBI:45979) is a 1,3-thiazoles (CHEBI:38418)
thiabendazole (CHEBI:45979) is a benzimidazole fungicide (CHEBI:87036)
thiabendazole (CHEBI:45979) is a benzimidazoles (CHEBI:22715)
IUPAC Name 
2-(1,3-thiazol-4-yl)-1H-benzimidazole
Synonyms  Source
ThiabendazoleKEGG COMPOUND
TiabendazoleKEGG COMPOUND
4-(2-benzimidazolyl)thiazoleChemIDplus
TBZChemIDplus
MK 360ChemIDplus
2-(1,3-THIAZOL-4-YL)-1H-BENZIMIDAZOLEPDBeChem
Brand Names  Source
ThibenzoleChemIDplus
EquizoleChemIDplus
MintezolKEGG DRUG
Manual XrefsDatabases
D00372KEGG DRUG
TMGPDBeChem
DB00730DrugBank
US3017415Patent
ThiabendazoleWikipedia
THIABENDAZOLEMetaCyc
HMDB0014868HMDB
thiabendazoleAlan Wood's Pesticides
LSM-3741LINCS
2621DrugCentral
629PPDB
629VSDB
Registry NumbersSources
Beilstein:611403Beilstein
Reaxys:611403Reaxys
CAS:148-79-8ChemIDplus
CAS:148-79-8NIST Chemistry WebBook
Citations