[(1R)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [(1R)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [(1R)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [(1R)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(dimethylamino)-2-oxo-1-phenylethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [(1R)-2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OC(C2=CC=CC=C2)C(=O)N(C)C

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)O[C@H](C2=CC=CC=C2)C(=O)N(C)C

InChI

InChI=1S/C20H21NO4S/c1-14(22)13-26-17-12-8-7-11-16(17)20(24)25-18(19(23)21(2)3)15-9-5-4-6-10-15/h4-12,18H,13H2,1-3H3/t18-/m1/s1