methyl 2-[2-(2-bromanylethanoyl)-6-methoxycarbonyl-5-(trifluoromethylsulfonyloxy)pyridin-3-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[2-(2-bromanylethanoyl)-6-methoxycarbonyl-5-(trifluoromethylsulfonyloxy)pyridin-3-yl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[2-(2-bromoacetyl)-6-methoxycarbonyl-5-(trifluoromethylsulfonyloxy)-3-pyridyl]thiazole-4-carboxylate CAS Name: 2-[2-(2-bromo-1-oxoethyl)-6-methoxycarbonyl-5-(trifluoromethylsulfonyloxy)-3-pyridinyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-bromoacetyl)-6-methoxycarbonyl-5-(trifluoromethylsulfonyloxy)pyridin-3-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[2-(2-bromoacetyl)-6-carbomethoxy-5-triflyloxy-3-pyridyl]thiazole-4-carboxylic acid methyl ester Formula: C15H10BrF3N2O8S2 MolecularWeight: 547.27771

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)C2=CC(=C(N=C2C(=O)CBr)C(=O)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CSC(=N1)C2=CC(=C(N=C2C(=O)CBr)C(=O)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C15H10BrF3N2O8S2/c1-27-13(23)7-5-30-12(20-7)6-3-9(29-31(25,26)15(17,18)19)11(14(24)28-2)21-10(6)8(22)4-16/h3,5H,4H2,1-2H3