methyl 2-(3-azanyl-2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-(4-phenylmethoxyphenyl)ethanoate

Systemtic Name: methyl 2-(3-azanyl-2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-(4-phenylmethoxyphenyl)ethanoate Openeye Name: methyl 2-(3-amino-2-methylsulfanyl-4-oxo-azetidin-1-yl)-2-(4-benzyloxyphenyl)acetate CAS Name: 2-[3-amino-2-(methylthio)-4-oxo-1-azetidinyl]-2-(4-phenylmethoxyphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-amino-2-methylsulfanyl-4-oxoazetidin-1-yl)-2-(4-phenylmethoxyphenyl)acetate Traditional Name: 2-[3-amino-2-keto-4-(methylthio)azetidin-1-yl]-2-(4-benzoxyphenyl)acetic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)OCC2=CC=CC=C2)N3C(C(C3=O)N)SC

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)OCC2=CC=CC=C2)N3C(C(C3=O)N)SC

InChI

InChI=1S/C20H22N2O4S/c1-25-20(24)17(22-18(23)16(21)19(22)27-2)14-8-10-15(11-9-14)26-12-13-6-4-3-5-7-13/h3-11,16-17,19H,12,21H2,1-2H3