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CHEBI:145500 - thiencarbazone-methyl

ChEBI IDCHEBI:145500
ChEBI Namethiencarbazone-methyl
Stars
DefinitionAn 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.
Last Modified26 November 2019
SubmitterAdnan
DownloadsMolfile
FormulaC12H14N4O7S2
Net Charge0
Average Mass390.399
Monoisotopic Mass390.03039
SMILESCOC(=O)c1csc(C)c1S(=O)(=O)NC(=O)n1nc(OC)n(C)c1=O
InChIInChI=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)
InChIKeyXSKZXGDFSCCXQX-UHFFFAOYSA-N
Roles Classification
Biological Role:
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).
Applications:
herbicide  A substance used to destroy plant pests.
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
ChEBI Ontology
Outgoing Relation(s)
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  Source
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 esterChEBI
BYH 18636PPDB
methyl 4-[[[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carbonyl]amino]sulfonyl]-5-methyl-3-thiophenecarboxylateAlan Wood's Pesticides
methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carbonylsulfamoyl]-5-methylthiophene-3-carboxylateAlan Wood's Pesticides
TCMPPDB
methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylateChEBI
Brand Names  Source
VelocityChEBI
CaprenoChEBI
CelsiusChEBI
CorvusChEBI
AutumnChEBI
AdengoChEBI
Manual XrefsDatabases
1241PPDB
/derivatives/thiencarbazone-methylAlan Wood's Pesticides
6R5PDBeChem
Registry NumbersSources
Reaxys:11327106Reaxys
CAS:317815-83-1ChemIDplus
Citations