methyl 1-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]piperidine-4-carboxylate CAS Name: 1-[2-oxo-2-[2-(phenylthio)ethylamino]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]piperidine-4-carboxylate Traditional Name: 1-[2-keto-2-[2-(phenylthio)ethylamino]ethyl]isonipecotic acid methyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)CC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CCN(CC1)CC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O3S/c1-22-17(21)14-7-10-19(11-8-14)13-16(20)18-9-12-23-15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,18,20)