CHEBI:5133 - fluthiacet-methyl

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ChEBI Name fluthiacet-methyl
ChEBI ID CHEBI:5133
Definition A methyl ester resulting from the formal condensation of the carboxy group of fluthiacet with methanol. A proherbicide for fluthiacet, it is used for the control of broad-leaved weeds in crops such as maize and soya.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H15ClFN3O3S2
Net Charge 0
Average Mass 403.882
Monoisotopic Mass 403.02274
InChI InChI=1S/C15H15ClFN3O3S2/c1-23-13(21)8-24-12-7-11(10(17)6-9(12)16)18-14-19-4-2-3-5-20(19)15(22)25-14/h6-7H,2-5,8H2,1H3
InChIKey ZCNQYNHDVRPZIH-UHFFFAOYSA-N
SMILES C1CCN2N(C1)C(SC2=NC3=C(C=C(C(=C3)SCC(=O)OC)Cl)F)=O
Roles Classification
Biological Role(s): EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor
An EC 1.3.3.* (oxidoreductase acting on donor CH-CH group with oxygen as acceptor) inhibitor that interferes with the action of protoporphyrinogen oxidase (EC 1.3.3.4).
Application(s): agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
proherbicide
A compound that, on administration, must undergo chemical conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the pharmacologically active herbicide for which it is a proherbicide.
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ChEBI Ontology
Outgoing fluthiacet-methyl (CHEBI:5133) has functional parent fluthiacet (CHEBI:82018)
fluthiacet-methyl (CHEBI:5133) has role agrochemical (CHEBI:33286)
fluthiacet-methyl (CHEBI:5133) has role EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor (CHEBI:73192)
fluthiacet-methyl (CHEBI:5133) has role proherbicide (CHEBI:136646)
fluthiacet-methyl (CHEBI:5133) is a methyl ester (CHEBI:25248)
fluthiacet-methyl (CHEBI:5133) is a monochlorobenzenes (CHEBI:83403)
fluthiacet-methyl (CHEBI:5133) is a monofluorobenzenes (CHEBI:83575)
fluthiacet-methyl (CHEBI:5133) is a organic sulfide (CHEBI:16385)
fluthiacet-methyl (CHEBI:5133) is a thiadiazolopyridazine (CHEBI:48874)
IUPAC Name
methyl [(2-chloro-4-fluoro-5-{[(1Ξ)-3-oxotetrahydro[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene]amino}phenyl)thio]acetate
Synonyms Sources
CGA 248757 ChemIDplus
CGA-248757 ChemIDplus
KIH 9201 ChemIDplus
KIH-9201 ChemIDplus
methyl 2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]acetate Alan Wood's Pesticides
methyl [(2-chloro-4-fluoro-5-{[(1Ξ)-3-oxo-5,6,7,8-tetrahydro-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene]amino}phenyl)sulfanyl]acetate Alan Wood's Pesticides
methyl {2-chloro-4-fluoro-5-[(EZ)-5,6,7,8-tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylideneamino]phenylthio}acetate Alan Wood's Pesticides
Brand Name Source
Action ChemIDplus
Manual Xrefs Databases
1499 PPDB
C10908 KEGG COMPOUND
derivatives/fluthiacet-methyl Alan Wood's Pesticides
EP273417 Patent
US4906279 Patent
View more database links
Registry Numbers Types Sources
11510131 Reaxys Registry Number Reaxys
117337-19-6 CAS Registry Number ChemIDplus
117337-19-6 CAS Registry Number Alan Wood's Pesticides
Citations Waiting for Citations Types Sources
IND20575782 Agricola citation Europe PMC
IND22000583 Agricola citation Europe PMC
IND23140097 Agricola citation Europe PMC
Last Modified
25 July 2018