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CAS 15908-64-2

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1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile

Description:
1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile, with the CAS number 15908-64-2, is a chemical compound that belongs to the class of pyrimidine derivatives. This substance features a pyrimidine ring, which is a six-membered heterocyclic structure containing two nitrogen atoms at positions 1 and 3. The compound is characterized by the presence of a carbonitrile group, which contributes to its reactivity and potential biological activity. The methylthio group enhances its lipophilicity, potentially influencing its pharmacokinetic properties. Additionally, the phenyl group attached to the pyrimidine ring can affect the compound's electronic properties and interactions with biological targets. This compound may exhibit various biological activities, making it of interest in medicinal chemistry and drug development. Its structural features suggest potential applications in the synthesis of pharmaceuticals or agrochemicals, although specific biological activities and applications would require further investigation through experimental studies.
Formula:C12H9N3OS
InChI:InChI=1S/C12H9N3OS/c1-17-12-9(7-13)11(16)14-10(15-12)8-5-3-2-4-6-8/h2-6H,1H3,(H,14,15,16)
InChI key:InChIKey=OUSBLYHTCSUCNF-UHFFFAOYSA-N
SMILES:S(C)C=1NC(=NC(=O)C1C#N)C2=CC=CC=C2
Synonyms:
  • 1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile
  • 4-(Methylsulfanyl)-6-Oxo-2-Phenyl-1,6-Dihydropyrimidine-5-Carbonitrile
  • 4-Methylsulfanyl-6-oxo-2-phenyl-1H-pyrimidine-5-carbonitrile
  • 5-Pyrimidinecarbonitrile, 1,4-dihydro-6-(methylthio)-4-oxo-2-phenyl-
  • 5-Pyrimidinecarbonitrile, 4-hydroxy-6-(methylthio)-2-phenyl-
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