1-[4-(phenylmethyl)piperidin-1-yl]-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propan-1-one Traditional Name: 1-(4-benzylpiperidino)-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]propan-1-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-18(30-17-22-25-23(26-29-22)21-10-6-3-7-11-21)24(28)27-14-12-20(13-15-27)16-19-8-4-2-5-9-19/h2-11,18,20H,12-17H2,1H3