1-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]-2-methylsulfanyl-ethanone

Systemtic Name: 1-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]-2-methylsulfanyl-ethanone Openeye Name: 1-[3-(hydroxymethyl)-3-(o-tolylmethyl)-1-piperidyl]-2-methylsulfanyl-ethanone CAS Name: 1-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]-1-piperidinyl]-2-(methylthio)ethanone IUPAC Name: 1-[3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]-2-methylsulfanylethanone Traditional Name: 1-[3-(2-methylbenzyl)-3-methylol-piperidino]-2-(methylthio)ethanone Formula: C17H25NO2S MolecularWeight: 307.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2(CCCN(C2)C(=O)CSC)CO

Isomeric SMILES

CC1=CC=CC=C1CC2(CCCN(C2)C(=O)CSC)CO

InChI

InChI=1S/C17H25NO2S/c1-14-6-3-4-7-15(14)10-17(13-19)8-5-9-18(12-17)16(20)11-21-2/h3-4,6-7,19H,5,8-13H2,1-2H3