4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]-2-methyl-butanoic acid

Systemtic Name: 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]-2-methyl-butanoic acid Openeye Name: 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)oxazol-2-yl]-2-methyl-butanoic acid CAS Name: 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-oxazolyl]-2-methylbutanoic acid IUPAC Name: 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]-2-methylbutanoic acid Traditional Name: 4-[4-(4-fluorophenyl)-5-(4-mesylphenyl)oxazol-2-yl]-2-methyl-butyric acid Formula: C21H20FNO5S MolecularWeight: 417.450603

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NC(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(CCC1=NC(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C21H20FNO5S/c1-13(21(24)25)3-12-18-23-19(14-4-8-16(22)9-5-14)20(28-18)15-6-10-17(11-7-15)29(2,26)27/h4-11,13H,3,12H2,1-2H3,(H,24,25)