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

Systemtic Name: 5-[[4-(4-methylphenyl)sulfanylpiperidin-1-yl]methyl]-3-phenethyl-1,2,4-oxadiazole Openeye Name: 3-phenethyl-5-[[4-(p-tolylsulfanyl)-1-piperidyl]methyl]-1,2,4-oxadiazole CAS Name: 5-[[4-[(4-methylphenyl)thio]-1-piperidinyl]methyl]-3-phenethyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-methylphenyl)sulfanylpiperidin-1-yl]methyl]-3-phenethyl-1,2,4-oxadiazole Traditional Name: 3-phenethyl-5-[[4-(p-tolylthio)piperidino]methyl]-1,2,4-oxadiazole Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CCN(CC2)CC3=NC(=NO3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2CCN(CC2)CC3=NC(=NO3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3OS/c1-18-7-10-20(11-8-18)28-21-13-15-26(16-14-21)17-23-24-22(25-27-23)12-9-19-5-3-2-4-6-19/h2-8,10-11,21H,9,12-17H2,1H3