5-[[4-(2-methylphenyl)sulfanylpiperidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(2-methylphenyl)sulfanylpiperidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(o-tolylsulfanyl)-1-piperidyl]methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[4-[(2-methylphenyl)thio]-1-piperidinyl]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(2-methylphenyl)sulfanylpiperidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[[4-(o-tolylthio)piperidino]methyl]-3-phenyl-1,2,4-oxadiazole Formula: C21H23N3OS MolecularWeight: 365.49182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2CCN(CC2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1SC2CCN(CC2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS/c1-16-7-5-6-10-19(16)26-18-11-13-24(14-12-18)15-20-22-21(23-25-20)17-8-3-2-4-9-17/h2-10,18H,11-15H2,1H3