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CHEBI:141068 - orthosulfamuron

ChEBI IDCHEBI:141068
ChEBI Nameorthosulfamuron
Stars
DefinitionAn N-sulfonylurea and sulfuric amide resulting from the formal condensation of sulfuric acid with the primary amino group of 1-(4,6-dimethoxypyrimidin-2-yl)urea and with the primary amino group of 2-amino-N,N-dimethylbenzamide (1 mol eq. of each). An acetolactate synthase inhibitor, it is used as a pre- and post-emergent herbicide for the treatment of grasses and broad-leaved weeds in rice crops.
Last Modified5 October 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H20N6O6S
Net Charge0
Average Mass424.439
Monoisotopic Mass424.11650
SMILESCOc1cc(OC)nc(NC(=O)NS(=O)(=O)Nc2ccccc2C(=O)N(C)C)n1
InChIInChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)
InChIKeyUCDPMNSCCRBWIC-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).
Application:
herbicide  A substance used to destroy plant pests.
ChEBI Ontology
Outgoing Relation(s)
orthosulfamuron (CHEBI:141068) has role EC 2.2.1.6 (acetolactate synthase) inhibitor (CHEBI:22180)
orthosulfamuron (CHEBI:141068) has role herbicide (CHEBI:24527)
orthosulfamuron (CHEBI:141068) is a N-sulfonylurea (CHEBI:76983)
orthosulfamuron (CHEBI:141068) is a aromatic ether (CHEBI:35618)
orthosulfamuron (CHEBI:141068) is a sulfuric amide (CHEBI:38038)
orthosulfamuron (CHEBI:141068) is a tertiary carboxamide (CHEBI:140326)
IUPAC Name 
2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}amino)-N,N-dimethylbenzamide
Synonyms  Source
1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]ureaAlan Wood's Pesticides
2-[[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]amino]-N,NN-dimethylbenzamideAlan Wood's Pesticides
IR 5878ChemIDplus
Brand Names  Source
StradaPPDB
KelionPPDB
PercutioPPDB
Manual XrefsDatabases
orthosulfamuronAlan Wood's Pesticides
1135PPDB
Registry NumbersSources
CAS:213464-77-8ChemIDplus
CAS:213464-77-8Alan Wood's Pesticides
Citations