2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]propanoic acid

Systemtic Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]propanoic acid Openeye Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)thiazol-2-yl]propanoic acid CAS Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-2-thiazolyl]propanoic acid IUPAC Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]propanoic acid Traditional Name: 2-[5-(4-fluorophenyl)-4-(2-mesylphenyl)thiazol-2-yl]propionic acid Formula: C19H16FNO4S2 MolecularWeight: 405.463043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=C(S1)C2=CC=C(C=C2)F)C3=CC=CC=C3S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC(C1=NC(=C(S1)C2=CC=C(C=C2)F)C3=CC=CC=C3S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C19H16FNO4S2/c1-11(19(22)23)18-21-16(14-5-3-4-6-15(14)27(2,24)25)17(26-18)12-7-9-13(20)10-8-12/h3-11H,1-2H3,(H,22,23)