nicosulfuron (CHEBI:7554)

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ChEBI Name	nicosulfuron

ChEBI ID	CHEBI:7554

Definition	A N-sulfonylurea that is 2-(carbamoylsulfamoyl)-N,N-dimethylpyridine-3-carboxamide substituted by a 4,6-dimethoxypyrimidin-2-yl group at the amino nitrogen.

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

Supplier Information

Download	Molfile XML SDF

Formula

C15H18N6O6S

Net Charge

Average Mass

410.40500

Monoisotopic Mass

410.10085

InChI

InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)

InChIKey

RTCOGUMHFFWOJV-UHFFFAOYSA-N

SMILES

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ncccc2C(=O)N(C)C)n1

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Role(s):	xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.

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

ChEBI Ontology
Outgoing	nicosulfuron (CHEBI:7554) has role environmental contaminant (CHEBI:78298) nicosulfuron (CHEBI:7554) has role herbicide (CHEBI:24527) nicosulfuron (CHEBI:7554) has role xenobiotic (CHEBI:35703) nicosulfuron (CHEBI:7554) is a N-sulfonylurea (CHEBI:76983) nicosulfuron (CHEBI:7554) is a pyridines (CHEBI:26421) nicosulfuron (CHEBI:7554) is a pyrimidines (CHEBI:39447)

IUPAC Name

2-{[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide

Last Modified

06 November 2014

General Comment
2014-10-29	Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag