Products 155862-93-4

CAS 155862-93-4 is the registry number for 1-[2-(4-Isothiocyanatophenoxy)ethyl]-4-[5-(4-methoxyphenyl)-2-oxazolyl] pyridinium tosylate. Offered by: Chemat. Available pack sizes: 250mg, 25mg, 50mg.

Structural formula: {0} (CAS {1})

2-[1-[2-(4-isothiocyanatophenoxy)ethyl]pyridin-1-ium-4-yl]-5-(4-methoxyphenyl)-1,3-oxazole;4-methylbenzenesulfonate (CAS 155862-93-4) is a chemical compound with the molecular formula C31H27N3O6S2 and a molecular weight of 601.7 g/mol. IUPAC name: 2-[1-[2-(4-isothiocyanatophenoxy)ethyl]pyridin-1-ium-4-yl]-5-(4-methoxyphenyl)-1,3-oxazole;4-methylbenzenesulfonate. InChIKey: AVQZDVMXRPILBE-UHFFFAOYSA-M.

Identity
Molecular formulaC31H27N3O6S2
Molecular weight601.7 g/mol
IUPAC name2-[1-[2-(4-isothiocyanatophenoxy)ethyl]pyridin-1-ium-4-yl]-5-(4-methoxyphenyl)-1,3-oxazole;4-methylbenzenesulfonate
InChIKeyAVQZDVMXRPILBE-UHFFFAOYSA-M
SMILESCC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=[N+](C=C3)CCOC4=CC=C(C=C4)N=C=S

Computed by PubChem (NCBI)