[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] (2S)-2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] (2S)-2-benzamido-4-methylsulfanyl-butanoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] (2S)-2-benzamido-4-methylsulfanyl-butanoate CAS Name: (2S)-2-benzamido-4-(methylthio)butanoic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] (2S)-2-benzamido-4-methylsulfanylbutanoate Traditional Name: (2S)-2-benzamido-4-(methylthio)butyric acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C20H20FNO4S MolecularWeight: 389.440503

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)C1=CC(=CC=C1)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)OCC(=O)C1=CC(=CC=C1)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20FNO4S/c1-27-11-10-17(22-19(24)14-6-3-2-4-7-14)20(25)26-13-18(23)15-8-5-9-16(21)12-15/h2-9,12,17H,10-11,13H2,1H3,(H,22,24)/t17-/m0/s1