2-(2-methylsulfanylphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]ethanone

Systemtic Name: 2-(2-methylsulfanylphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]ethanone Openeye Name: 1-(1-benzyl-4-piperidyl)-2-(2-methylsulfanylphenyl)ethanone CAS Name: 2-[2-(methylthio)phenyl]-1-[1-(phenylmethyl)-4-piperidinyl]ethanone IUPAC Name: 1-(1-benzylpiperidin-4-yl)-2-(2-methylsulfanylphenyl)ethanone Traditional Name: 1-(1-benzyl-4-piperidyl)-2-[2-(methylthio)phenyl]ethanone Formula: C21H25NOS MolecularWeight: 339.4943

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CC(=O)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1CC(=O)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25NOS/c1-24-21-10-6-5-9-19(21)15-20(23)18-11-13-22(14-12-18)16-17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3