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

Systemtic Name: S-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] ethanethioate Openeye Name: S-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] ethanethioate CAS Name: ethanethioic acid S-[(1S,2R)-2-(dimethylamino)-1-phenylpropyl] ester IUPAC Name: S-[(1S,2R)-2-(dimethylamino)-1-phenylpropyl] ethanethioate Traditional Name: ethanethioic acid S-[(1S,2R)-2-(dimethylamino)-1-phenyl-propyl] ester Formula: C13H19NOS MolecularWeight: 237.36106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NOS/c1-10(14(3)4)13(16-11(2)15)12-8-6-5-7-9-12/h5-10,13H,1-4H3/t10-,13-/m1/s1