isoxaflutole
CHEBI:CHEBI_141213
Definition
A member of the class of isoxazoles that is 1,2-oxazole substituted by a 2-(methanesulfonyl)-4-(trifluoromethyl)benzoyl group and a cyclopropyl group at positions 4 and 5, respectively. It is a 4-hydroxyphenylpyruvate dioxygenase inhibitor which is used as a herbicide for weed control in maize and sugarcane.
Chemical Information
- Molecular Formula
- C15H12F3NO4S
- Molecular Mass
- 359.322
- Charge
- 0
- SMILES
- CS(C=1C=C(C=CC1C(C=2C=NOC2C3CC3)=O)C(F)(F)F)(=O)=O
- InChI
- InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3
- InChIKey
- OYIKARCXOQLFHF-UHFFFAOYSA-N
Alternative Names
- (5-cyclopropyl-1,2-oxazol-4-yl)(alpha,alpha,alpha-trifluoro-2-mesyl-p-tolyl)methanone
- (5-cyclopropyl-1,2-oxazol-4-yl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]methanone
- (5-cyclopropyl-4-isoxazolyl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]methanone
- (5-cyclopropylisoxazol-4-yl)(alpha,alpha,alpha-trifluoro-2-mesyl-p-tolyl)methanone
- 5-cyclopropyl-1,2-oxazol-4-yl alpha,alpha,alpha-trifluoro-2-mesyl-p-tolyl ketone
- 5-cyclopropyl-4-[2-methanesulfonyl-4-(trifluoromethyl)benzoyl]-1,2-oxazole
- Balance
- EXP 31130A
- Merlin
- RP 201772
- RPA 201772
Drug Classification
-
isoxazolesView Class →
CHEBI:55373
-
sulfoneView Class →
CHEBI:35850
-
cyclopropanesView Class →
CHEBI:51454
-
aromatic ketoneView Class →
CHEBI:76224
-
(trifluoromethyl)benzenesView Class →
CHEBI:83565
-
t107778
-
t108813
-
t108913
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- DRON_00010000
- 1371313
- oboInOwl#hasDbXref
- Reaxys:8344543
- core#notation
- CHEBI:141213
Additional References
🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.
Additional Attributes
- oboInOwl#hasOBONamespace
- chebi_ontology
- DRON_00010000
- 1371313
- oboInOwl#hasDbXref
- Reaxys:8344543
- oboInOwl#id
- CHEBI:141213
- core#notation
- CHEBI:141213
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_38317
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- owl#annotatedSource
- t108836
- owl#someValuesFrom
- t1345792