(phenylmethyl) 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-4-oxidanylidene-azetidin-1-yl]-3-bromanylsulfanyl-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-4-oxidanylidene-azetidin-1-yl]-3-bromanylsulfanyl-3-methyl-butanoate Openeye Name: benzyl 2-[2-bromo-3-(1,3-dioxoisoindolin-2-yl)-4-oxo-azetidin-1-yl]-3-bromosulfanyl-3-methyl-butanoate CAS Name: 2-[2-bromo-3-(1,3-dioxo-2-isoindolyl)-4-oxo-1-azetidinyl]-3-(bromothio)-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-bromo-3-(1,3-dioxoisoindol-2-yl)-4-oxoazetidin-1-yl]-3-bromosulfanyl-3-methylbutanoate Traditional Name: 2-(2-bromo-4-keto-3-phthalimido-azetidin-1-yl)-3-(bromothio)-3-methyl-butyric acid benzyl ester Formula: C23H20Br2N2O5S MolecularWeight: 596.2883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)Br)SBr

Isomeric SMILES

CC(C)(C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)Br)SBr

InChI

InChI=1S/C23H20Br2N2O5S/c1-23(2,33-25)17(22(31)32-12-13-8-4-3-5-9-13)27-18(24)16(21(27)30)26-19(28)14-10-6-7-11-15(14)20(26)29/h3-11,16-18H,12H2,1-2H3