1-[3-(hydroxymethyl)piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[3-(hydroxymethyl)-1-piperidyl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[3-(hydroxymethyl)-1-piperidinyl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-(3-methylolpiperidino)-2-(4-pyridylthio)ethanone Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=NC=C2)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=CC=NC=C2)CO

InChI

InChI=1S/C13H18N2O2S/c16-9-11-2-1-7-15(8-11)13(17)10-18-12-3-5-14-6-4-12/h3-6,11,16H,1-2,7-10H2