CHEBI:131599 - dicloromezotiaz

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ChEBI Name dicloromezotiaz
ChEBI ID CHEBI:131599
Definition A pyridopyrimidine that is 9-methyl-2,4-dioxo-2H-pyrido[1,2-a]pyrimidine substituted at positions 1 and 3 by (2-chloro-1,3-thiazol-5-yl)methyl and 3,5-dichlorophenyl groups respectively. A mesoionic insecticide used for control of rice hoppers.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H12Cl3N3O2S
Net Charge 0
Average Mass 452.743
Monoisotopic Mass 450.97158
InChI InChI=1S/C19H12Cl3N3O2S/c1-10-3-2-4-24-16(10)25(9-14-8-23-19(22)28-14)18(27)15(17(24)26)11-5-12(20)7-13(21)6-11/h2-8H,9H2,1H3
InChIKey PVDQXPBKBSCNJZ-UHFFFAOYSA-N
SMILES N12C(=[N+](C([C-](C1=O)C3=CC(=CC(=C3)Cl)Cl)=O)CC=4SC(=NC4)Cl)C(=CC=C2)C
Roles Classification
Application(s): agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
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 organochlorine insecticide )
pesticide
Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
(via organochlorine pesticide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dicloromezotiaz (CHEBI:131599) has role agrochemical (CHEBI:33286)
dicloromezotiaz (CHEBI:131599) is a 1,3-thiazoles (CHEBI:38418)
dicloromezotiaz (CHEBI:131599) is a dichlorobenzene (CHEBI:23697)
dicloromezotiaz (CHEBI:131599) is a iminium betaine (CHEBI:35285)
dicloromezotiaz (CHEBI:131599) is a organochlorine insecticide (CHEBI:25705)
dicloromezotiaz (CHEBI:131599) is a pyridopyrimidine (CHEBI:38932)
IUPAC Name
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-(3,5-dichlorophenyl)-9-methyl-2,4-dioxo-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-1-ium-3-ide
Synonym Source
1-[(2-chloro-5-thiazolyl)methyl]-3-(3,5-dichlorophenyl)-9-methyl-2,4-dioxo-2H-pyrido[1,2-a]pyrimidinium inner salt Alan Wood's Pesticides
Manual Xrefs Databases
3092 PPDB
dicloromezotiaz Alan Wood's Pesticides
View more database links
Registry Number Type Source
1263629-39-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
27896932 PubMed citation Europe PMC
28087271 PubMed citation Europe PMC
28825462 PubMed citation Europe PMC
34986308 PubMed citation Europe PMC
35394767 PubMed citation Europe PMC
Last Modified
25 May 2022