methyl 4-(4-fluorophenyl)-6-propan-2-yl-2-(trifluoromethylsulfonyloxy)pyrimidine-5-carboxylate

Systemtic Name: methyl 4-(4-fluorophenyl)-6-propan-2-yl-2-(trifluoromethylsulfonyloxy)pyrimidine-5-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-6-isopropyl-2-(trifluoromethylsulfonyloxy)pyrimidine-5-carboxylate CAS Name: 4-(4-fluorophenyl)-6-propan-2-yl-2-(trifluoromethylsulfonyloxy)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-6-propan-2-yl-2-(trifluoromethylsulfonyloxy)pyrimidine-5-carboxylate Traditional Name: 4-(4-fluorophenyl)-6-isopropyl-2-triflyloxy-pyrimidine-5-carboxylic acid methyl ester Formula: C16H14F4N2O5S MolecularWeight: 422.351373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H14F4N2O5S/c1-8(2)12-11(14(23)26-3)13(9-4-6-10(17)7-5-9)22-15(21-12)27-28(24,25)16(18,19)20/h4-8H,1-3H3