1-[3-[[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]methyl]phenyl]ethanone

Systemtic Name: 1-[3-[[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]methyl]phenyl]ethanone Openeye Name: 1-[3-[[3-(4-methylsulfanylbenzoyl)-1-piperidyl]methyl]phenyl]ethanone CAS Name: 1-[3-[[3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]methyl]phenyl]ethanone IUPAC Name: 1-[3-[[3-(4-methylsulfanylbenzoyl)piperidin-1-yl]methyl]phenyl]ethanone Traditional Name: 1-[3-[[3-[4-(methylthio)benzoyl]piperidino]methyl]phenyl]ethanone Formula: C22H25NO2S MolecularWeight: 367.5044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H25NO2S/c1-16(24)19-6-3-5-17(13-19)14-23-12-4-7-20(15-23)22(25)18-8-10-21(26-2)11-9-18/h3,5-6,8-11,13,20H,4,7,12,14-15H2,1-2H3