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CAS 680214-83-9

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O-[5-[(3,4-Dichlorophenyl)methyl]-6-methyl-2-(2-pyridinyl)-4-pyrimidinyl] O,O-diethyl phosphorothioate

Description:
O-[5-[(3,4-Dichlorophenyl)methyl]-6-methyl-2-(2-pyridinyl)-4-pyrimidinyl] O,O-diethyl phosphorothioate is a chemical compound that belongs to the class of organophosphates, which are characterized by the presence of phosphorus and sulfur in their structure. This compound features a phosphorothioate group, indicating that one of the oxygen atoms in the phosphate is replaced by a sulfur atom, which can influence its reactivity and biological activity. The presence of the 3,4-dichlorophenyl and pyridinyl moieties suggests potential applications in agrochemicals or pharmaceuticals, as these groups can enhance the compound's interaction with biological targets. Organophosphates are known for their ability to inhibit acetylcholinesterase, an enzyme critical for nerve function, which can lead to neurotoxic effects. The specific structural features of this compound may also impart unique properties, such as solubility and stability, which are important for its intended applications. Safety and handling precautions are essential due to the potential toxicity associated with organophosphate compounds.
Formula:C21H22Cl2N3O3PS
InChI:InChI=1S/C21H22Cl2N3O3PS/c1-4-27-30(31,28-5-2)29-21-16(12-15-9-10-17(22)18(23)13-15)14(3)25-20(26-21)19-8-6-7-11-24-19/h6-11,13H,4-5,12H2,1-3H3
InChI key:InChIKey=JQKHXGCOBSHDBH-UHFFFAOYSA-N
SMILES:C(C=1C(OP(OCC)(OCC)=S)=NC(=NC1C)C2=CC=CC=N2)C3=CC(Cl)=C(Cl)C=C3
Synonyms:
  • O-[5-[(3,4-Dichlorophenyl)methyl]-6-methyl-2-(2-pyridinyl)-4-pyrimidinyl] O,O-diethyl phosphorothioate
  • Phosphorothioic acid, O-[5-[(3,4-dichlorophenyl)methyl]-6-methyl-2-(2-pyridinyl)-4-pyrimidinyl] O,O-diethyl ester
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