N'-(3-methylsulfanylphenyl)-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(3-methylsulfanylphenyl)-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N-[(1-benzyl-4-piperidyl)methyl]-N'-(3-methylsulfanylphenyl)oxamide CAS Name: N'-[3-(methylthio)phenyl]-N-[[1-(phenylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)methyl]-N'-(3-methylsulfanylphenyl)oxamide Traditional Name: N-[(1-benzyl-4-piperidyl)methyl]-N'-[3-(methylthio)phenyl]oxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2S/c1-28-20-9-5-8-19(14-20)24-22(27)21(26)23-15-17-10-12-25(13-11-17)16-18-6-3-2-4-7-18/h2-9,14,17H,10-13,15-16H2,1H3,(H,23,26)(H,24,27)