ethametsulfuron (CHEBI:145551)

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ChEBI Name	ethametsulfuron

ChEBI ID	CHEBI:145551

Definition	An N-sulfonylurea that is urea in which one of the nitrogens has been substituted by a 4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl group, while the other has been substituted by a (2-carboxyphenyl)sulfonyl group.

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

Supplier Information

Download	Molfile XML SDF

Formula

C14H16N6O6S

Net Charge

Average Mass

396.380

Monoisotopic Mass

396.08520

InChI

InChI=1S/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)

InChIKey

IRLGCAJYYKDTCG-UHFFFAOYSA-N

SMILES

C1(=NC(=NC(=N1)NC(NS(C=2C(=CC=CC2)C(=O)O)(=O)=O)=O)OCC)NC

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Application(s):	herbicide A substance used to destroy plant pests.

ChEBI Ontology
Outgoing	ethametsulfuron (CHEBI:145551) has role herbicide (CHEBI:24527) ethametsulfuron (CHEBI:145551) is a N-sulfonylurea (CHEBI:76983) ethametsulfuron (CHEBI:145551) is a aromatic ether (CHEBI:35618) ethametsulfuron (CHEBI:145551) is a benzoic acids (CHEBI:22723) ethametsulfuron (CHEBI:145551) is a diamino-1,3,5-triazine (CHEBI:38170)

Incoming	ethametsulfuron-methyl (CHEBI:145553) has functional parent ethametsulfuron (CHEBI:145551)

IUPAC Name

2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid

Synonyms	Sources
1-[(2-carboxyphenyl)sulfonyl]-3-[4-(methylamino)-6-ethoxy-1,3,5-triazine-2-yl]urea	ChEBI
2-[[[[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]carbonyl]amino]sulfonyl]benzoic acid	Alan Wood's Pesticides

Last Modified

02 December 2019