inpyrfluxam (CHEBI:166908)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:166908 - inpyrfluxam

Take structure to advanced search

ChEBI ID	CHEBI:166908
ChEBI Name	inpyrfluxam
Stars
Definition	A member of the class of indanes that is indane substituted by methyl groups at positions 1,1 and 3R and by a [3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbonyl]amino group at position 4. It is a fungicide that is a Complex II succinate dehydrogenase inhibitor, which is a functional part of the tricarboxylic acid cycle and linked to the mitochondrial electron transport chain. It exhibits high efficacy against major plant diseases including Brown Rust on wheat, Net Blotch on barley, and Black Scurf on potato.
Last Modified	26 November 2020
Submitter	Adnan
Downloads	Molfile

Formula	C18H21F2N3O
Net Charge	0
Average Mass	333.382
Monoisotopic Mass	333.16527
SMILES	C[C@@H]1CC(C)(C)c2cccc(NC(=O)c3cn(C)nc3C(F)F)c21
InChI	InChI=1S/C18H21F2N3O/c1-10-8-18(2,3)12-6-5-7-13(14(10)12)21-17(24)11-9-23(4)22-15(11)16(19)20/h5-7,9-10,16H,8H2,1-4H3,(H,21,24)/t10-/m1/s1
InChIKey	YTCIYOXHHQLDEI-SNVBAGLBSA-N

Roles Classification

Biological Roles:	fungicide A substance used to destroy fungal pests. EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor An EC 1.3.5.* (oxidoreductase acting on CH-CH of donor with a quinone or related compound as acceptor) inhibitor that interferes with the action of succinate dehydrogenase (quinone), EC 1.3.5.1.
Applications:	fungicide A substance used to destroy fungal pests. pesticide Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.

ChEBI Ontology

Outgoing Relation(s)
	inpyrfluxam (CHEBI:166908) has role EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor (CHEBI:83072)
	inpyrfluxam (CHEBI:166908) has role fungicide (CHEBI:24127)
	inpyrfluxam (CHEBI:166908) is a indanes (CHEBI:46940)
	inpyrfluxam (CHEBI:166908) is a organofluorine pesticide (CHEBI:38805)
	inpyrfluxam (CHEBI:166908) is a pyrazoles (CHEBI:26410)
	inpyrfluxam (CHEBI:166908) is a secondary carboxamide (CHEBI:140325)

IUPAC Name
3-(difluoromethyl)-1-methyl-N-[(3R)-1,1,3-trimethyl-2,3-dihydro-1H-inden-4-yl]-1H-pyrazole-4-carboxamide

Synonyms	Source
3-(difluoromethyl)-N-[(R)-2,3-dihydro-1,1,3-trimethyl-1H-inden-4-yl]-1-methylpyrazole-4-carboxamide	ChEBI
3-(difluoromethyl)-N-[(R)-2,3-dihydro-1,1,3-trimethyl-1H-inden-4-yl]-1-methyl-1H-pyrazole-4-carboxamide	Alan Wood's Pesticides
3-(difluoromethyl)-N-[(3R)-2,3-dihydro-1,1,3-trimethyl-1H-inden-4-yl]-1-methyl-1H-pyrazole-4-carboxamide	Alan Wood's Pesticides
inpyrfluxame	ChEBI

Brand Name	Source
Indiflin	ChEBI

Manual Xrefs	Databases
inpyrfluxam	Alan Wood's Pesticides
59403484	ChemSpider
US5093347	Patent
WO2011162397	Patent

Registry Numbers	Sources
Reaxys:22546627	Reaxys
CAS:1352994-67-2	ChemIDplus

Citations