1-[2-(hydroxymethyl)piperidin-1-yl]-3-(4-methylphenyl)sulfanyl-propan-1-one

Systemtic Name: 1-[2-(hydroxymethyl)piperidin-1-yl]-3-(4-methylphenyl)sulfanyl-propan-1-one Openeye Name: 1-[2-(hydroxymethyl)-1-piperidyl]-3-(p-tolylsulfanyl)propan-1-one CAS Name: 1-[2-(hydroxymethyl)-1-piperidinyl]-3-[(4-methylphenyl)thio]-1-propanone IUPAC Name: 1-[2-(hydroxymethyl)piperidin-1-yl]-3-(4-methylphenyl)sulfanylpropan-1-one Traditional Name: 1-(2-methylolpiperidino)-3-(p-tolylthio)propan-1-one Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N2CCCCC2CO

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N2CCCCC2CO

InChI

InChI=1S/C16H23NO2S/c1-13-5-7-15(8-6-13)20-11-9-16(19)17-10-3-2-4-14(17)12-18/h5-8,14,18H,2-4,9-12H2,1H3