(5S)-5-fluoranyl-3-[4-(2-methylpropoxy)phenyl]sulfonyl-6-oxidanylidene-4,5-dihydropyrimidin-2-olate

Systemtic Name: (5S)-5-fluoranyl-3-[4-(2-methylpropoxy)phenyl]sulfonyl-6-oxidanylidene-4,5-dihydropyrimidin-2-olate Openeye Name: (5S)-5-fluoro-3-(4-isobutoxyphenyl)sulfonyl-6-oxo-4,5-dihydropyrimidin-2-olate CAS Name: (5S)-5-fluoro-3-[4-(2-methylpropoxy)phenyl]sulfonyl-6-oxo-4,5-dihydropyrimidin-2-olate IUPAC Name: (5S)-5-fluoro-3-[4-(2-methylpropoxy)phenyl]sulfonyl-6-oxo-4,5-dihydropyrimidin-2-olate Traditional Name: (5S)-5-fluoro-3-(4-isobutoxyphenyl)sulfonyl-6-keto-4,5-dihydropyrimidin-2-olate Formula: C14H16FN2O5S- MolecularWeight: 343.350643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)S(=O)(=O)N2CC(C(=O)N=C2[O-])F

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C(=O)N=C2[O-])F

InChI

InChI=1S/C14H17FN2O5S/c1-9(2)8-22-10-3-5-11(6-4-10)23(20,21)17-7-12(15)13(18)16-14(17)19/h3-6,9,12H,7-8H2,1-2H3,(H,16,18,19)/p-1/t12-/m0/s1