fomesafen (CHEBI:81925)

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ChEBI Name	fomesafen

ChEBI ID	CHEBI:81925

Definition	An N-sulfonylcarboxamide that is N-(methylsulfonyl)benzamide in which the phenyl ring is substituted by a nitro group at position 2 and a 2-chloro-4-(trifluoromethyl)phenoxy group at position 5. A protoporphyrinogen oxidase inhibitor, it was specially developed for use (generally as the corresponding sodium salt, fomesafen-sodium) for post-emergence control of broad-leaf weeds in soya.

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

Supplier Information	ChemicalBook:CB9347894, eMolecules:511214, ZINC000001851764

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Formula

C15H10ClF3N2O6S

Net Charge

Average Mass

438.765

Monoisotopic Mass

437.99002

InChI

InChI=1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22)

InChIKey

BGZZWXTVIYUUEY-UHFFFAOYSA-N

SMILES

C1=C(C=C(C(=C1)OC2=CC=C(C(=C2)C(=O)NS(C)(=O)=O)[N+]([O-])=O)Cl)C(F)(F)F

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

ChEBI Ontology
Outgoing	fomesafen (CHEBI:81925) has role agrochemical (CHEBI:33286) fomesafen (CHEBI:81925) has role EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor (CHEBI:73192) fomesafen (CHEBI:81925) has role herbicide (CHEBI:24527) fomesafen (CHEBI:81925) is a C-nitro compound (CHEBI:35716) fomesafen (CHEBI:81925) is a N-sulfonylcarboxamide (CHEBI:90852) fomesafen (CHEBI:81925) is a aromatic ether (CHEBI:35618) fomesafen (CHEBI:81925) is a monochlorobenzenes (CHEBI:83403) fomesafen (CHEBI:81925) is a organofluorine compound (CHEBI:37143) fomesafen (CHEBI:81925) is a phenols (CHEBI:33853) fomesafen (CHEBI:81925) is conjugate acid of fomesafen(1−) (CHEBI:138163)

Incoming	fomesafen(1−) (CHEBI:138163) is conjugate base of fomesafen (CHEBI:81925)

IUPAC Name

5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-(methylsulfonyl)-2-nitrobenzamide

Synonyms	Sources
5-(2-chloro-α,α,α-trifluoro-p-tolyloxy)-N-mesyl-2-nitrobenzamide	Alan Wood's Pesticides
5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-(methanesulfonyl)-2-nitrobenzamide	Alan Wood's Pesticides
5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-mesyl-2-nitrobenzamide	ChEBI
fomésafène	ChEBI

Citations

Last Modified

11 August 2017