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

Systemtic Name: tert-butyl 3-methyl-2-[2-oxidanylidene-3-[[2-[1-[2,2,2-tris(chloranyl)ethoxycarbonyloxy]ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-3-enoate Openeye Name: tert-butyl 3-methyl-2-[2-oxo-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-3-enoate CAS Name: 3-methyl-2-[2-oxo-3-[[2-[1-[oxo(2,2,2-trichloroethoxy)methoxy]ethyl]-1,3-benzothiazol-4-yl]disulfanyl]-1-azetidinyl]-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 3-methyl-2-[2-oxo-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]but-3-enoate Traditional Name: 2-[2-keto-3-[[2-[1-(2,2,2-trichloroethoxycarbonyloxy)ethyl]-1,3-benzothiazol-4-yl]disulfanyl]azetidin-1-yl]-3-methyl-but-3-enoic acid tert-butyl ester Formula: C24H27Cl3N2O6S3 MolecularWeight: 642.03498

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H27Cl3N2O6S3/c1-12(2)18(21(31)35-23(4,5)6)29-10-16(20(29)30)38-37-15-9-7-8-14-17(15)28-19(36-14)13(3)34-22(32)33-11-24(25,26)27/h7-9,13,16,18H,1,10-11H2,2-6H3