5-[1-(4-methylphenyl)sulfanylethyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[1-(4-methylphenyl)sulfanylethyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 3-phenyl-5-[1-(p-tolylsulfanyl)ethyl]-1,2,4-oxadiazole CAS Name: 5-[1-[(4-methylphenyl)thio]ethyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[1-(4-methylphenyl)sulfanylethyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 3-phenyl-5-[1-(p-tolylthio)ethyl]-1,2,4-oxadiazole Formula: C17H16N2OS MolecularWeight: 296.38674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2OS/c1-12-8-10-15(11-9-12)21-13(2)17-18-16(19-20-17)14-6-4-3-5-7-14/h3-11,13H,1-2H3