tert-butyl (E)-3-methylsulfonyloxy-2-[2-oxidanylidene-3-[[2-[1-[2,2,2-tris(chloranyl)ethoxycarbonyloxy]ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-2-enoate

Systemtic Name: tert-butyl (E)-3-methylsulfonyloxy-2-[2-oxidanylidene-3-[[2-[1-[2,2,2-tris(chloranyl)ethoxycarbonyloxy]ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-2-enoate Openeye Name: tert-butyl (E)-3-methylsulfonyloxy-2-[2-oxo-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-2-enoate CAS Name: (E)-3-methylsulfonyloxy-2-[2-oxo-3-[[2-[1-[oxo(2,2,2-trichloroethoxy)methoxy]ethyl]-1,3-benzothiazol-4-yl]disulfanyl]-1-azetidinyl]-2-butenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-methylsulfonyloxy-2-[2-oxo-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-2-enoate Traditional Name: (E)-2-[2-keto-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]-3-methylsulfonyloxy-but-2-enoic acid tert-butyl ester Formula: C24H27Cl3N2O9S4 MolecularWeight: 722.09818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(S1)C=CC=C2SSC3CN(C3=O)C(=C(C)OS(=O)(=O)C)C(=O)OC(C)(C)C)OC(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

CC(C1=NC2=C(S1)C=CC=C2SSC3CN(C3=O)/C(=C(\C)/OS(=O)(=O)C)/C(=O)OC(C)(C)C)OC(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C24H27Cl3N2O9S4/c1-12(38-42(6,33)34)18(21(31)37-23(3,4)5)29-10-16(20(29)30)41-40-15-9-7-8-14-17(15)28-19(39-14)13(2)36-22(32)35-11-24(25,26)27/h7-9,13,16H,10-11H2,1-6H3/b18-12+