CHEBI:146239 - pyrafluprole

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ChEBI Name pyrafluprole
ChEBI ID CHEBI:146239
Definition A member of the class of pyrazoles that is 1H-pyrazole which is substituted by a 2,6-dichloro-4-(trifluoromethyl)phenyl, nitrile, (fluoromethyl)sulfanediyl and [(pyrazin-2-yl)methyl]nitrilo groups at positions 1,3,4 and 5, respectively. It is an experimental insecticide introduced by Nihon Nohyaku Co Ltd, Japan.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H10Cl2F4N6S
Net Charge 0
Average Mass 477.260
Monoisotopic Mass 476.00008
InChI InChI=1S/C17H10Cl2F4N6S/c18-11-3-9(17(21,22)23)4-12(19)14(11)29-16(15(30-8-20)13(5-24)28-29)27-7-10-6-25-1-2-26-10/h1-4,6,27H,7-8H2
InChIKey DDIQWGKUSJOETH-UHFFFAOYSA-N
SMILES C=1C(=CC(=C(C1Cl)N2N=C(C(=C2NCC3=NC=CN=C3)SCF)C#N)Cl)C(F)(F)F
Roles Classification
Application(s): insecticide
Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
(via phenylpyrazole insecticide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pyrafluprole (CHEBI:146239) is a (trifluoromethyl)benzenes (CHEBI:83565)
pyrafluprole (CHEBI:146239) is a dichlorobenzene (CHEBI:23697)
pyrafluprole (CHEBI:146239) is a nitrile (CHEBI:18379)
pyrafluprole (CHEBI:146239) is a organic sulfide (CHEBI:16385)
pyrafluprole (CHEBI:146239) is a phenylpyrazole insecticide (CHEBI:39090)
IUPAC Name
1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(fluoromethyl)sulfanyl]-5-[(pyrazin-2-ylmethyl)amino]-1H-pyrazole-3-carbonitrile
Synonyms Sources
1-(2,6-dichloro-α,α,α-trifluoro-p-tolyl)-4-[(fluoromethyl)thio]-5-[(pyrazinylmethyl)amino]-1H-pyrazole-3-carbonitrile Alan Wood's Pesticides
1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(fluoromethyl)thio]-5-[(2-pyrazinylmethyl)amino]-1H-pyrazole-3-carbonitrile Alan Wood's Pesticides
V 3039 ChEBI
V-3039 ChEBI
V3039 ChEBI
Manual Xrefs Databases
3071 PPDB
pyrafluprole Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
18528378 Reaxys Registry Number Reaxys
315208-17-4 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
24823815 PubMed citation Europe PMC
Last Modified
28 February 2020