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

Systemtic Name: methyl 4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfonyloxy-6-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-6-isopropyl-2-(2-nitrophenyl)sulfonyloxy-pyrimidine-5-carboxylate CAS Name: 4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfonyloxy-6-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfonyloxy-6-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 4-(4-fluorophenyl)-6-isopropyl-2-(2-nitrophenyl)sulfonyloxy-pyrimidine-5-carboxylic acid methyl ester Formula: C21H18FN3O7S MolecularWeight: 475.446923

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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=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)OS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H18FN3O7S/c1-12(2)18-17(20(26)31-3)19(13-8-10-14(22)11-9-13)24-21(23-18)32-33(29,30)16-7-5-4-6-15(16)25(27)28/h4-12H,1-3H3