(3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxo-1-(2-pyridylmethyl)piperidine-3-carboxamide CAS Name: (3S)-N-[[4-(methylthio)phenyl]methyl]-6-oxo-1-(2-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxo-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-N-[4-(methylthio)benzyl]-1-(2-pyridylmethyl)nipecotamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2CCC(=O)N(C2)CC3=CC=CC=N3

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)[C@H]2CCC(=O)N(C2)CC3=CC=CC=N3

InChI

InChI=1S/C20H23N3O2S/c1-26-18-8-5-15(6-9-18)12-22-20(25)16-7-10-19(24)23(13-16)14-17-4-2-3-11-21-17/h2-6,8-9,11,16H,7,10,12-14H2,1H3,(H,22,25)/t16-/m0/s1