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

Systemtic Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]pentanoic acid Openeye Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)thiazol-2-yl]pentanoic acid CAS Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-2-thiazolyl]pentanoic acid IUPAC Name: 2-[5-(4-fluorophenyl)-4-(2-methylsulfonylphenyl)-1,3-thiazol-2-yl]pentanoic acid Traditional Name: 2-[5-(4-fluorophenyl)-4-(2-mesylphenyl)thiazol-2-yl]valeric acid Formula: C21H20FNO4S2 MolecularWeight: 433.516203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20FNO4S2/c1-3-6-16(21(24)25)20-23-18(15-7-4-5-8-17(15)29(2,26)27)19(28-20)13-9-11-14(22)12-10-13/h4-5,7-12,16H,3,6H2,1-2H3,(H,24,25)