[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [(1S)-2-morpholino-2-oxo-1-phenyl-ethyl] 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [(1S)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C22H26N2O6S2 MolecularWeight: 478.58164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H26N2O6S2/c25-21(23-12-14-29-15-13-23)20(17-5-2-1-3-6-17)30-22(26)18-8-10-24(11-9-18)32(27,28)19-7-4-16-31-19/h1-7,16,18,20H,8-15H2/t20-/m0/s1