1-[3-(hydroxymethyl)piperidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Openeye Name: 1-[3-(hydroxymethyl)-1-piperidyl]-2-(p-tolylmethylsulfanyl)ethanone CAS Name: 1-[3-(hydroxymethyl)-1-piperidinyl]-2-[(4-methylphenyl)methylthio]ethanone IUPAC Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Traditional Name: 2-[(4-methylbenzyl)thio]-1-(3-methylolpiperidino)ethanone Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)N2CCCC(C2)CO

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)N2CCCC(C2)CO

InChI

InChI=1S/C16H23NO2S/c1-13-4-6-14(7-5-13)11-20-12-16(19)17-8-2-3-15(9-17)10-18/h4-7,15,18H,2-3,8-12H2,1H3