thiencarbazone-methyl (CHEBI:145500)

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ChEBI Name	thiencarbazone-methyl

ChEBI ID	CHEBI:145500

Definition	An N-sulfonylurea in which the sulfur atom is attached to a 4-(methoxycarbonyl)-2-methylthiophen-3-yl group and in which the non-sulfonated nitrogen is substituted by a 3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl group. It is a herbicide used for the selective control of grasses and broadleaf weeds primarily in corn.

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

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Formula

C12H14N4O7S2

Net Charge

Average Mass

390.390

Monoisotopic Mass

390.03039

InChI

InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)

InChIKey

XSKZXGDFSCCXQX-UHFFFAOYSA-N

SMILES

S(NC(=O)N1C(N(C(=N1)OC)C)=O)(C2=C(SC=C2C(=O)OC)C)(=O)=O

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

ChEBI Ontology
Outgoing	thiencarbazone-methyl (CHEBI:145500) has functional parent thiencarbazone (CHEBI:145501) thiencarbazone-methyl (CHEBI:145500) has role agrochemical (CHEBI:33286) thiencarbazone-methyl (CHEBI:145500) has role EC 2.2.1.6 (acetolactate synthase) inhibitor (CHEBI:22180) thiencarbazone-methyl (CHEBI:145500) has role herbicide (CHEBI:24527) thiencarbazone-methyl (CHEBI:145500) is a N-sulfonylurea (CHEBI:76983) thiencarbazone-methyl (CHEBI:145500) is a ether (CHEBI:25698) thiencarbazone-methyl (CHEBI:145500) is a methyl ester (CHEBI:25248) thiencarbazone-methyl (CHEBI:145500) is a thiophenes (CHEBI:26961) thiencarbazone-methyl (CHEBI:145500) is a triazoles (CHEBI:35727)

IUPAC Name

methyl 4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate

Synonyms	Sources
3-[N-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazole-1-yl)carbonyl]sulfamoyl]-2-methyl-4-thiophenecarboxylic acid methyl ester	ChEBI
BYH 18636	PPDB
methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carbonylsulfamoyl]-5-methylthiophene-3-carboxylate	Alan Wood's Pesticides
methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate	ChEBI
methyl 4-[[[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carbonyl]amino]sulfonyl]-5-methyl-3-thiophenecarboxylate	Alan Wood's Pesticides
TCM	PPDB

Manual Xrefs	Databases
/derivatives/thiencarbazone-methyl	Alan Wood's Pesticides
1241	PPDB
6R5	PDBeChem
View more database links

Last Modified

26 November 2019