S-[(1S,2R)-1-phenyl-2-piperidin-1-yl-propyl] ethanethioate

Systemtic Name: S-[(1S,2R)-1-phenyl-2-piperidin-1-yl-propyl] ethanethioate Openeye Name: S-[(1S,2R)-1-phenyl-2-(1-piperidyl)propyl] ethanethioate CAS Name: ethanethioic acid S-[(1S,2R)-1-phenyl-2-(1-piperidinyl)propyl] ester IUPAC Name: S-[(1S,2R)-1-phenyl-2-piperidin-1-ylpropyl] ethanethioate Traditional Name: ethanethioic acid S-[(1S,2R)-1-phenyl-2-piperidino-propyl] ester Formula: C16H23NOS MolecularWeight: 277.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)SC(=O)C)N2CCCCC2

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)SC(=O)C)N2CCCCC2

InChI

InChI=1S/C16H23NOS/c1-13(17-11-7-4-8-12-17)16(19-14(2)18)15-9-5-3-6-10-15/h3,5-6,9-10,13,16H,4,7-8,11-12H2,1-2H3/t13-,16-/m1/s1