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

Systemtic Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]butanoic acid Openeye Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)thiazol-2-yl]butanoic acid CAS Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-2-thiazolyl]butanoic acid IUPAC Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]butanoic acid Traditional Name: 2-[5-(4-fluorophenyl)-4-(2-mesylphenyl)thiazol-2-yl]butyric acid Formula: C20H18FNO4S2 MolecularWeight: 419.489623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18FNO4S2/c1-3-14(20(23)24)19-22-17(15-6-4-5-7-16(15)28(2,25)26)18(27-19)12-8-10-13(21)11-9-12/h4-11,14H,3H2,1-2H3,(H,23,24)