6-[6-(3-azido-2-triethylsilyloxy-propyl)-7-methylsulfanyl-imidazo[5,1-b][1,3]thiazol-6-ium-2-yl]-4-methyl-7-oxidanylidene-6-[1-(trifluoromethylsulfonyloxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-[6-(3-azido-2-triethylsilyloxy-propyl)-7-methylsulfanyl-imidazo[5,1-b][1,3]thiazol-6-ium-2-yl]-4-methyl-7-oxidanylidene-6-[1-(trifluoromethylsulfonyloxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-[6-(3-azido-2-triethylsilyloxy-propyl)-7-methylsulfanyl-imidazo[5,1-b]thiazol-6-ium-2-yl]-4-methyl-7-oxo-6-[1-(trifluoromethylsulfonyloxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-[6-(3-azido-2-triethylsilyloxypropyl)-7-(methylthio)-2-imidazo[5,1-b]thiazol-6-iumyl]-4-methyl-7-oxo-6-[1-(trifluoromethylsulfonyloxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-[6-(3-azido-2-triethylsilyloxypropyl)-7-methylsulfanylimidazo[5,1-b][1,3]thiazol-6-ium-2-yl]-4-methyl-7-oxo-6-[1-(trifluoromethylsulfonyloxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-[6-(3-azido-2-triethylsilyloxy-propyl)-7-(methylthio)imidazo[5,1-b]thiazol-6-ium-2-yl]-7-keto-4-methyl-6-(1-triflyloxyethyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C26H35F3N6O7S3Si MolecularWeight: 724.86781

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Descriptors Computed from Structure

Canonical SMILES:

CC[Si](CC)(CC)OC(CN=[N+]=[N-])C[N+]1=CN2C=C(SC2=C1SC)C3(C4C(C=C(N4C3=O)C(=O)[O-])C)C(C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC[Si](CC)(CC)OC(CN=[N+]=[N-])C[N+]1=CN2C=C(SC2=C1SC)C3(C4C(C=C(N4C3=O)C(=O)[O-])C)C(C)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C26H35F3N6O7S3Si/c1-7-46(8-2,9-3)42-17(11-31-32-30)12-33-14-34-13-19(44-22(34)21(33)43-6)25(16(5)41-45(39,40)26(27,28)29)20-15(4)10-18(23(36)37)35(20)24(25)38/h10,13-17,20H,7-9,11-12H2,1-6H3