[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-(4-ethanoylphenoxy)butanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-(4-ethanoylphenoxy)butanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-(4-acetylphenoxy)butanoate CAS Name: 4-(4-acetylphenoxy)butanoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-(4-acetylphenoxy)butanoate Traditional Name: 4-(4-acetylphenoxy)butyric acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCCCC(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCCCC(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C22H25NO5S/c1-17(24)18-9-11-19(12-10-18)27-14-5-8-22(26)28-16-21(25)23-13-15-29-20-6-3-2-4-7-20/h2-4,6-7,9-12H,5,8,13-16H2,1H3,(H,23,25)