Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:82042 - sulfometuron
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
sulfometuron
ChEBI ID
CHEBI:82042
Definition
An
N
-sulfonylurea that is urea substituted by 4,6-dimethylpyrimidin-2-yl and (2-carboxyphenyl)sulfonyl groups at positions 1 and 3, respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
more structures >>
Molfile
Formula
C14H14N4O5S
Net Charge
0
Average Mass
350.350
Monoisotopic Mass
350.06849
InChI
InChI=1S/C14H14N4O5S/c1-
8-
7-
9(2)
16-
13(15-
8)
17-
14(21)
18-
24(22,23)
11-
6-
4-
3-
5-
10(11)
12(19)
20/h3-
7H,1-
2H3,(H,19,20)
(H2,15,16,17,18,21)
InChIKey
FZMKKCQHDROFNI-UHFFFAOYSA-N
SMILES
CC1=CC(C)=NC(NC(=O)NS(=O)(=O)C2=CC=CC=C2C(O)=O)=N1
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
sulfometuron (
CHEBI:82042
)
has role
EC 2.2.1.6 (acetolactate synthase) inhibitor (
CHEBI:22180
)
sulfometuron (
CHEBI:82042
)
has role
herbicide (
CHEBI:24527
)
sulfometuron (
CHEBI:82042
)
is a
N
-sulfonylurea (
CHEBI:76983
)
sulfometuron (
CHEBI:82042
)
is a
benzoic acids (
CHEBI:22723
)
sulfometuron (
CHEBI:82042
)
is a
monocarboxylic acid (
CHEBI:25384
)
sulfometuron (
CHEBI:82042
)
is a
pyrimidines (
CHEBI:39447
)
Incoming
sulfometuron methyl (
CHEBI:9348
)
has functional parent
sulfometuron (
CHEBI:82042
)
IUPAC Name
2-{[(4,6-dimethylpyrimidin-2-yl)carbamoyl]sulfamoyl}benzoic acid
Synonyms
Sources
2-(3-(4,6-dimethylpyrimidin-2-yl)ureidosulfonyl)benzoic acid
ChemIDplus
2-[3-(4,6-dimethylpyrimidin-2-yl)ureidosulfonyl]benzoic acid
ChEBI
2-[[[[(4,6-dimethyl-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]benzoic acid
Alan Wood's Pesticides
sulfométuron
ChEBI
Manual Xrefs
Databases
47882
ChemSpider
C18895
KEGG COMPOUND
sulfometuron
Alan Wood's Pesticides
View more database links
Registry Numbers
Types
Sources
74223-56-6
CAS Registry Number
ChemIDplus
937935
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11982411
PubMed citation
Europe PMC
11982412
PubMed citation
Europe PMC
14572103
PubMed citation
Europe PMC
16159170
PubMed citation
Europe PMC
17325226
PubMed citation
Europe PMC
20821425
PubMed citation
Europe PMC
20872651
PubMed citation
Europe PMC
22383419
PubMed citation
Europe PMC
24307082
PubMed citation
Europe PMC
27976507
PubMed citation
Europe PMC
Last Modified
15 October 2021