2-[2-(Furan-2-Ylmethylsulfanyl)Ethylamino]-5-[(6-Methylpyridin-3-Yl)Methyl]-3H-Pyrimidin-4-One
[CAS# 72717-05-6]

Identification

• Name: 2-[2-(Furan-2-Ylmethylsulfanyl)Ethylamino]-5-[(6-Methylpyridin-3-Yl)Methyl]-3H-Pyrimidin-4-One
• Synonyms: 2-[2-(2-Furylmethylsulfanyl)Ethylamino]-5-[(6-Methyl-3-Pyridyl)Methyl]-3H-Pyrimidin-4-One; 2-[2-(2-Furylmethylthio)Ethylamino]-5-[(6-Methyl-3-Pyridyl)Methyl]-3H-Pyrimidin-4-One; 2-((2-((2-Furylmethyl)Thio)Ethyl)Amino)-5-((6-Methyl-3-Pyridyl)Methyl)-1H-Pyrimidin-4-One
• Molecular Formula: C₁₈H₂₀N₄O₂S
• Molecular Weight: 356.44
• CAS Registry Number: 72717-05-6
• EINECS: 276-782-4
• SMILES: C1=CC(=NC=C1CC3=CN=C(NCCSCC2=CC=CO2)NC3=O)C
• InChI: 1S/C18H20N4O2S/c1-13-4-5-14(10-20-13)9-15-11-21-18(22-17(15)23)19-6-8-25-12-16-3-2-7-24-16/h2-5,7,10-11H,6,8-9,12H2,1H3,(H2,19,21,22,23)
• InChIKey: NLSZIIMWVUOOAT-UHFFFAOYSA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 534.5°C at 760 mmHg (Cal.)
• Flash point: 277°C (Cal.)