(4-oxidanylpiperidin-1-yl)-[2-(phenylmethylsulfanyl)pyridin-3-yl]methanone

Systemtic Name: (4-oxidanylpiperidin-1-yl)-[2-(phenylmethylsulfanyl)pyridin-3-yl]methanone Openeye Name: (2-benzylsulfanyl-3-pyridyl)-(4-hydroxy-1-piperidyl)methanone CAS Name: (4-hydroxy-1-piperidinyl)-[2-(phenylmethylthio)-3-pyridinyl]methanone IUPAC Name: (2-benzylsulfanylpyridin-3-yl)-(4-hydroxypiperidin-1-yl)methanone Traditional Name: [2-(benzylthio)-3-pyridyl]-(4-hydroxypiperidino)methanone Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1O)C(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c21-15-8-11-20(12-9-15)18(22)16-7-4-10-19-17(16)23-13-14-5-2-1-3-6-14/h1-7,10,15,21H,8-9,11-13H2