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

Systemtic Name: (phenylmethyl) 4-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-oxidanylidene-2-phenyl-butanoate Openeye Name: benzyl 4-(2-methylsulfanyl-4-oxo-azetidin-1-yl)-3-oxo-2-phenyl-butanoate CAS Name: 4-[2-(methylthio)-4-oxo-1-azetidinyl]-3-oxo-2-phenylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-methylsulfanyl-4-oxoazetidin-1-yl)-3-oxo-2-phenylbutanoate Traditional Name: 3-keto-4-[2-keto-4-(methylthio)azetidin-1-yl]-2-phenyl-butyric acid benzyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CC(=O)N1CC(=O)C(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CSC1CC(=O)N1CC(=O)C(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H21NO4S/c1-27-19-12-18(24)22(19)13-17(23)20(16-10-6-3-7-11-16)21(25)26-14-15-8-4-2-5-9-15/h2-11,19-20H,12-14H2,1H3