1-[2-(2,4-dimethylphenyl)sulfanylethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(2,4-dimethylphenyl)sulfanylethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-(2,4-dimethylphenyl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(2,4-dimethylphenyl)thio]-1-oxoethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-(2,4-dimethylphenyl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-[(2,4-dimethylphenyl)thio]acetyl]isonipecotamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C23H28N2O2S/c1-17-8-9-21(18(2)14-17)28-16-22(26)25-12-10-20(11-13-25)23(27)24-15-19-6-4-3-5-7-19/h3-9,14,20H,10-13,15-16H2,1-2H3,(H,24,27)