flucarbazone (CHEBI:138417)

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ChEBI Name	flucarbazone

ChEBI ID	CHEBI:138417

Definition	An N-sulfonylurea that is 3-methoxy-4-methyl-5-oxo-4,5-dihydro-1,2,4-triazole-1-carboxamide in which the carboxamide nitrogen has undergone formal condensation with the sulfonic acid group of 2-(trifluoromethoxy)benzenesulfonic acid. An acetolactate synthase inhibitor, it is used (generally as the corresponding sodium salt, flucarbazone-sodium) to control grass weeds in cereal crops.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C12H11F3N4O6S

Net Charge

Average Mass

396.301

Monoisotopic Mass

396.03514

InChI

InChI=1S/C12H11F3N4O6S/c1-18-10(24-2)16-19(11(18)21)9(20)17-26(22,23)8-6-4-3-5-7(8)25-12(13,14)15/h3-6H,1-2H3,(H,17,20)

InChIKey

GINFBXXYGUODAT-UHFFFAOYSA-N

SMILES

C=1(N(C(N(N1)C(NS(C2=CC=CC=C2OC(F)(F)F)(=O)=O)=O)=O)C)OC

Roles Classification
Biological Role(s):	EC 2.2.1.6 (acetolactate synthase) inhibitor An EC 2.2.1.* (transketolase/transaldolase) inhibitor that interferes with the action of acetolactate synthase (EC 2.2.1.6).

Application(s):	agrochemical An agrochemical is a substance that is used in agriculture or horticulture. herbicide A substance used to destroy plant pests.

ChEBI Ontology
Outgoing	flucarbazone (CHEBI:138417) has role agrochemical (CHEBI:33286) flucarbazone (CHEBI:138417) has role EC 2.2.1.6 (acetolactate synthase) inhibitor (CHEBI:22180) flucarbazone (CHEBI:138417) has role herbicide (CHEBI:24527) flucarbazone (CHEBI:138417) is a N-sulfonylurea (CHEBI:76983) flucarbazone (CHEBI:138417) is a aromatic ether (CHEBI:35618) flucarbazone (CHEBI:138417) is a organofluorine compound (CHEBI:37143) flucarbazone (CHEBI:138417) is a triazoles (CHEBI:35727) flucarbazone (CHEBI:138417) is conjugate acid of flucarbazone(1−) (CHEBI:138418)

Incoming	flucarbazone(1−) (CHEBI:138418) is conjugate base of flucarbazone (CHEBI:138417)

IUPAC Name

3-methoxy-4-methyl-5-oxo-N-{[2-(trifluoromethoxy)phenyl]sulfonyl}-4,5-dihydro-1H-1,2,4-triazole-1-carboxamide

Synonyms	Sources
4,5-dihydro-3-methoxy-4-methyl-5-oxo-N-[2-(trifluoromethoxy)phenylsulfonyl]-1H-1,2,4-triazole-1-carboxamide	Alan Wood's Pesticides
4,5-dihydro-3-methoxy-4-methyl-5-oxo-N-[[2-(trifluoromethoxy)phenyl]sulfonyl]-1H-1,2,4-triazole-1-carboxamide	Alan Wood's Pesticides

Citation	Type	Source
IND604666675	Agricola citation	Europe PMC

Last Modified

11 September 2017