EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:67113 - chlorantraniliprole

ChEBI IDCHEBI:67113
ChEBI Namechlorantraniliprole
Stars
DefinitionA carboxamide resulting from the formal condensation of the carboxylic acid group of 3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylic acid with the primary amino group of 2-amino-5-chloro-N,3-dimethylbenzamide. The first of the anthranilic diamide insecticides, it is a ryanodine receptor activator and is used to protect a wide variety of crops, including corn, cotton, grapes, rice and potatoes.
Last Modified25 February 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H14BrCl2N5O2
Net Charge0
Average Mass483.153
Monoisotopic Mass480.97079
SMILESCNC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl
InChIInChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)
InChIKeyPSOVNZZNOMJUBI-UHFFFAOYSA-N
Roles Classification
Biological Role:
ryanodine receptor agonist  A ryanodine receptor modulator which activates the receptor. Ryanodine receptors (RyRs) act as selective ion channels, modulating the release of calcium. Activating the receptors causes the release of calcium, so depleting internal calcium and ultimately preventing further muscle contraction.
Application:
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)
chlorantraniliprole (CHEBI:67113) has role ryanodine receptor agonist (CHEBI:67114)
chlorantraniliprole (CHEBI:67113) is a monochlorobenzenes (CHEBI:83403)
chlorantraniliprole (CHEBI:67113) is a organobromine compound (CHEBI:37141)
chlorantraniliprole (CHEBI:67113) is a pyrazole insecticide (CHEBI:26409)
chlorantraniliprole (CHEBI:67113) is a pyrazoles (CHEBI:26410)
chlorantraniliprole (CHEBI:67113) is a pyridines (CHEBI:26421)
chlorantraniliprole (CHEBI:67113) is a secondary carboxamide (CHEBI:140325)
IUPAC Name 
3-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide
Synonyms  Source
3-bromo-N-{4-chloro-2-methyl-6-[(methylamino)carbonyl]phenyl}-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamideChemIDplus
DPX-E2Y45ChEBI
Brand Name  Source
RynaxpyrChEBI
Manual XrefsDatabases
C18454KEGG COMPOUND
1138PPDB
Registry NumbersSources
Reaxys:11247880Reaxys
CAS:500008-45-7ChemIDplus
CAS:500008-45-7KEGG COMPOUND
Citations