methyl 4-methylsulfanyl-2-(2-oxidanylidene-4-phenyl-3-phenylmethoxy-azetidin-1-yl)butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-(2-oxidanylidene-4-phenyl-3-phenylmethoxy-azetidin-1-yl)butanoate Openeye Name: methyl 2-(3-benzyloxy-2-oxo-4-phenyl-azetidin-1-yl)-4-methylsulfanyl-butanoate CAS Name: 4-(methylthio)-2-(2-oxo-4-phenyl-3-phenylmethoxy-1-azetidinyl)butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-(2-oxo-4-phenyl-3-phenylmethoxyazetidin-1-yl)butanoate Traditional Name: 2-(3-benzoxy-2-keto-4-phenyl-azetidin-1-yl)-4-(methylthio)butyric acid methyl ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)N1C(C(C1=O)OCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CCSC)N1C(C(C1=O)OCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO4S/c1-26-22(25)18(13-14-28-2)23-19(17-11-7-4-8-12-17)20(21(23)24)27-15-16-9-5-3-6-10-16/h3-12,18-20H,13-15H2,1-2H3