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

Systemtic Name: methyl 2-(4-chlorophenyl)sulfonyloxy-4-(4-fluorophenyl)-6-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 2-(4-chlorophenyl)sulfonyloxy-4-(4-fluorophenyl)-6-isopropyl-pyrimidine-5-carboxylate CAS Name: 2-(4-chlorophenyl)sulfonyloxy-4-(4-fluorophenyl)-6-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)sulfonyloxy-4-(4-fluorophenyl)-6-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 2-(4-chlorophenyl)sulfonyloxy-4-(4-fluorophenyl)-6-isopropyl-pyrimidine-5-carboxylic acid methyl ester Formula: C21H18ClFN2O5S MolecularWeight: 464.894423

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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)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)OS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClFN2O5S/c1-12(2)18-17(20(26)29-3)19(13-4-8-15(23)9-5-13)25-21(24-18)30-31(27,28)16-10-6-14(22)7-11-16/h4-12H,1-3H3