tert-butyl N-[[2-methyl-3-[2,2,2-tris(chloranyl)ethanoyl]imidazo[1,2-a]pyridin-5-yl]methyl]-N-[4-(trifluoromethylsulfonylamino)butyl]carbamate

Systemtic Name: tert-butyl N-[[2-methyl-3-[2,2,2-tris(chloranyl)ethanoyl]imidazo[1,2-a]pyridin-5-yl]methyl]-N-[4-(trifluoromethylsulfonylamino)butyl]carbamate Openeye Name: tert-butyl N-[[2-methyl-3-(2,2,2-trichloroacetyl)imidazo[1,2-a]pyridin-5-yl]methyl]-N-[4-(trifluoromethylsulfonylamino)butyl]carbamate CAS Name: N-[[2-methyl-3-(2,2,2-trichloro-1-oxoethyl)-5-imidazo[1,2-a]pyridinyl]methyl]-N-[4-(trifluoromethylsulfonylamino)butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-methyl-3-(2,2,2-trichloroacetyl)imidazo[1,2-a]pyridin-5-yl]methyl]-N-[4-(trifluoromethylsulfonylamino)butyl]carbamate Traditional Name: N-[[2-methyl-3-(2,2,2-trichloroacetyl)imidazo[1,2-a]pyridin-5-yl]methyl]-N-[4-(triflylamino)butyl]carbamic acid tert-butyl ester Formula: C21H26Cl3F3N4O5S MolecularWeight: 609.87415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=N1)C=CC=C2CN(CCCCNS(=O)(=O)C(F)(F)F)C(=O)OC(C)(C)C)C(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CC1=C(N2C(=N1)C=CC=C2CN(CCCCNS(=O)(=O)C(F)(F)F)C(=O)OC(C)(C)C)C(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C21H26Cl3F3N4O5S/c1-13-16(17(32)20(22,23)24)31-14(8-7-9-15(31)29-13)12-30(18(33)36-19(2,3)4)11-6-5-10-28-37(34,35)21(25,26)27/h7-9,28H,5-6,10-12H2,1-4H3