1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]-2-phenylsulfanyl-ethanone CAS Name: 1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]-2-(phenylthio)ethanone IUPAC Name: 1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-phenylsulfanylethanone Traditional Name: 1-[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidino]-2-(phenylthio)ethanone Formula: C21H20ClN3O2S MolecularWeight: 413.9204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=CC=C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=CC=CC=C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H20ClN3O2S/c22-17-8-4-6-15(12-17)20-23-21(27-24-20)16-7-5-11-25(13-16)19(26)14-28-18-9-2-1-3-10-18/h1-4,6,8-10,12,16H,5,7,11,13-14H2