1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidyl]-2-phenylsulfanyl-ethanone CAS Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethyl-1-piperidinyl]-2-(phenylthio)ethanone IUPAC Name: 1-[(3R)-3-(hydroxymethyl)-3-phenethylpiperidin-1-yl]-2-phenylsulfanylethanone Traditional Name: 1-[(3R)-3-methylol-3-phenethyl-piperidino]-2-(phenylthio)ethanone Formula: C22H27NO2S MolecularWeight: 369.52028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=CC=C2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@](CN(C1)C(=O)CSC2=CC=CC=C2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C22H27NO2S/c24-18-22(14-12-19-8-3-1-4-9-19)13-7-15-23(17-22)21(25)16-26-20-10-5-2-6-11-20/h1-6,8-11,24H,7,12-18H2/t22-/m0/s1