N-(3-methylphenyl)-3-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]propanamide

Systemtic Name: N-(3-methylphenyl)-3-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]propanamide Openeye Name: N-(m-tolyl)-3-[1-(2-phenylsulfanylacetyl)-4-piperidyl]propanamide CAS Name: N-(3-methylphenyl)-3-[1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]propanamide IUPAC Name: N-(3-methylphenyl)-3-[1-(2-phenylsulfanylacetyl)piperidin-4-yl]propanamide Traditional Name: N-(m-tolyl)-3-[1-[2-(phenylthio)acetyl]-4-piperidyl]propionamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCC2CCN(CC2)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCC2CCN(CC2)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S/c1-18-6-5-7-20(16-18)24-22(26)11-10-19-12-14-25(15-13-19)23(27)17-28-21-8-3-2-4-9-21/h2-9,16,19H,10-15,17H2,1H3,(H,24,26)