[2-(dimethylamino)-3-phenyl-1-sulfanyl-propyl] ethanoate

Systemtic Name: [2-(dimethylamino)-3-phenyl-1-sulfanyl-propyl] ethanoate Openeye Name: [2-(dimethylamino)-3-phenyl-1-sulfanyl-propyl] acetate CAS Name: acetic acid [2-(dimethylamino)-1-mercapto-3-phenylpropyl] ester IUPAC Name: [2-(dimethylamino)-3-phenyl-1-sulfanylpropyl] acetate Traditional Name: acetic acid [2-(dimethylamino)-1-mercapto-3-phenyl-propyl] ester Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(CC1=CC=CC=C1)N(C)C)S

Isomeric SMILES

CC(=O)OC(C(CC1=CC=CC=C1)N(C)C)S

InChI

InChI=1S/C13H19NO2S/c1-10(15)16-13(17)12(14(2)3)9-11-7-5-4-6-8-11/h4-8,12-13,17H,9H2,1-3H3