[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methylsulfanylbenzoate Openeye Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C18H19NO3S/c1-19(2)17(20)16(13-7-5-4-6-8-13)22-18(21)14-9-11-15(23-3)12-10-14/h4-12,16H,1-3H3/t16-/m0/s1