methyl 2-(1-acetamido-2-ethanoylsulfanyl-3-oxidanylidene-4-phenyl-azetidin-2-yl)-2-(3-bromanyl-4-methoxy-phenyl)ethanoate

Systemtic Name: methyl 2-(1-acetamido-2-ethanoylsulfanyl-3-oxidanylidene-4-phenyl-azetidin-2-yl)-2-(3-bromanyl-4-methoxy-phenyl)ethanoate Openeye Name: methyl 2-(1-acetamido-2-acetylsulfanyl-3-oxo-4-phenyl-azetidin-2-yl)-2-(3-bromo-4-methoxy-phenyl)acetate CAS Name: 2-[1-acetamido-2-(acetylthio)-3-oxo-4-phenyl-2-azetidinyl]-2-(3-bromo-4-methoxyphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(1-acetamido-2-acetylsulfanyl-3-oxo-4-phenylazetidin-2-yl)-2-(3-bromo-4-methoxyphenyl)acetate Traditional Name: 2-[1-acetamido-2-(acetylthio)-3-keto-4-phenyl-azetidin-2-yl]-2-(3-bromo-4-methoxy-phenyl)acetic acid methyl ester Formula: C23H23BrN2O6S MolecularWeight: 535.40752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(C(=O)C1(C(C2=CC(=C(C=C2)OC)Br)C(=O)OC)SC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NN1C(C(=O)C1(C(C2=CC(=C(C=C2)OC)Br)C(=O)OC)SC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C23H23BrN2O6S/c1-13(27)25-26-20(15-8-6-5-7-9-15)21(29)23(26,33-14(2)28)19(22(30)32-4)16-10-11-18(31-3)17(24)12-16/h5-12,19-20H,1-4H3,(H,25,27)