N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
[CAS# 864685-28-9]

Identification

• Name: N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
• Synonyms: 3-PYRIDINECARBOXAMIDE,N-(2,2-DIMETHOXYETHYL)-6-[5-(PHENYLTHIO)-2-THIENYL]-
• Molecular Formula: C₂₀H₂₀N₂O₃S₂
• Molecular Weight: 400.51
• CAS Registry Number: 864685-28-9
• SMILES: COC(OC)CNC(=O)c1ccc(nc1)c3ccc(Sc2ccccc2)s3
• InChI: 1S/C20H20N2O3S2/c1-24-18(25-2)13-22-20(23)14-8-9-16(21-12-14)17-10-11-19(27-17)26-15-6-4-3-5-7-15/h3-12,18H,13H2,1-2H3,(H,22,23)
• InChIKey: NVCMXIXPZUZJMN-UHFFFAOYSA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 604.565°C at 760 mmHg (Cal.)
• Flash point: 319.43°C (Cal.)
• Refractive index: 1.644 (Cal.)