[(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-methylsulfanylbenzoate

Systemtic Name: [(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-methylsulfanylbenzoate Openeye Name: [(1S)-2-(3-acetylanilino)-2-oxo-1-phenyl-ethyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [(1S)-2-(3-acetylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C24H21NO4S MolecularWeight: 419.49284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C24H21NO4S/c1-16(26)19-9-6-10-20(15-19)25-23(27)22(17-7-4-3-5-8-17)29-24(28)18-11-13-21(30-2)14-12-18/h3-15,22H,1-2H3,(H,25,27)/t22-/m0/s1