ethyl 1-[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2S)-2-phenyl-2-phenylsulfanyl-acetyl]piperidine-4-carboxylate CAS Name: 1-[(2S)-1-oxo-2-phenyl-2-(phenylthio)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2S)-2-phenyl-2-phenylsulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-2-phenyl-2-(phenylthio)acetyl]isonipecotic acid ethyl ester Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)[C@H](C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H25NO3S/c1-2-26-22(25)18-13-15-23(16-14-18)21(24)20(17-9-5-3-6-10-17)27-19-11-7-4-8-12-19/h3-12,18,20H,2,13-16H2,1H3/t20-/m0/s1