1-(cyclohexylmethyl)-N-[(3-methylsulfanylphenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: 1-(cyclohexylmethyl)-N-[(3-methylsulfanylphenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: 1-(cyclohexylmethyl)-N-[(3-methylsulfanylphenyl)methyl]-6-oxo-piperidine-3-carboxamide CAS Name: 1-(cyclohexylmethyl)-N-[[3-(methylthio)phenyl]methyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: 1-(cyclohexylmethyl)-N-[(3-methylsulfanylphenyl)methyl]-6-oxopiperidine-3-carboxamide Traditional Name: 1-(cyclohexylmethyl)-6-keto-N-[3-(methylthio)benzyl]nipecotamide Formula: C21H30N2O2S MolecularWeight: 374.5401

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)CNC(=O)C2CCC(=O)N(C2)CC3CCCCC3

Isomeric SMILES

CSC1=CC=CC(=C1)CNC(=O)C2CCC(=O)N(C2)CC3CCCCC3

InChI

InChI=1S/C21H30N2O2S/c1-26-19-9-5-8-17(12-19)13-22-21(25)18-10-11-20(24)23(15-18)14-16-6-3-2-4-7-16/h5,8-9,12,16,18H,2-4,6-7,10-11,13-15H2,1H3,(H,22,25)