1-[2-(4-Isothiocyanatophenoxy)Ethyl]-4-[5-(4-Methoxyphenyl)-1,3-Oxazol-2-Yl]Pyridinium 4-Methylbenzenesulfonate
[CAS# 155862-93-4]

Identification

• Name: 1-[2-(4-Isothiocyanatophenoxy)Ethyl]-4-[5-(4-Methoxyphenyl)-1,3-Oxazol-2-Yl]Pyridinium 4-Methylbenzenesulfonate
• Synonyms: 1-[2- ethyl]-4-[5- -2-oxazolyl]pyridiniumtosylate; 1-[2-(4-Isothiocyanatophenoxy)ethyl]-4-[5-(4-methoxyphenyl)-2-oxazolyl] pyridinium tosylate; 1-[2-(4-Isothiocyanatophenoxy)ethyl]-4-[5-(4-methoxyphenyl)-2-oxazolyl]pyridinium tosylate
• Molecular Formula: C₃₁H₂₇N₃O₆S₂
• Molecular Weight: 601.69
• CAS Registry Number: 155862-93-4
• SMILES: [O-]S(=O)(=O)c1ccc(cc1)C.S=C=N\c4ccc(OCC[n+]3ccc(c1ncc(o1)c2ccc(OC)cc2)cc3)cc4
• InChI: 1S/C24H20N3O3S.C7H8O3S/c1-28-21-6-2-18(3-7-21)23-16-25-24(30-23)19-10-12-27(13-11-19)14-15-29-22-8-4-20(5-9-22)26-17-31;1-6-2-4-7(5-3-6)11(8,9)10/h2-13,16H,14-15H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
• InChIKey: AVQZDVMXRPILBE-UHFFFAOYSA-M

Properties

• Refractive index: (Cal.)