2-methylpropyl 6-(4-fluorophenyl)-2-methylsulfonyloxy-pyrimidine-4-carboxylate

Systemtic Name: 2-methylpropyl 6-(4-fluorophenyl)-2-methylsulfonyloxy-pyrimidine-4-carboxylate Openeye Name: isobutyl 6-(4-fluorophenyl)-2-methylsulfonyloxy-pyrimidine-4-carboxylate CAS Name: 6-(4-fluorophenyl)-2-methylsulfonyloxy-4-pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-(4-fluorophenyl)-2-methylsulfonyloxypyrimidine-4-carboxylate Traditional Name: 6-(4-fluorophenyl)-2-methylsulfonyloxy-pyrimidine-4-carboxylic acid isobutyl ester Formula: C16H17FN2O5S MolecularWeight: 368.379983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=NC(=NC(=C1)C2=CC=C(C=C2)F)OS(=O)(=O)C

Isomeric SMILES

CC(C)COC(=O)C1=NC(=NC(=C1)C2=CC=C(C=C2)F)OS(=O)(=O)C

InChI

InChI=1S/C16H17FN2O5S/c1-10(2)9-23-15(20)14-8-13(11-4-6-12(17)7-5-11)18-16(19-14)24-25(3,21)22/h4-8,10H,9H2,1-3H3