5-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonyl-2-fluoranyl-benzoic acid

Systemtic Name: 5-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonyl-2-fluoranyl-benzoic acid Openeye Name: 5-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonyl-2-fluoro-benzoic acid CAS Name: 5-[4-(5-acetyl-4-methyl-2-thiazolyl)phenoxy]sulfonyl-2-fluorobenzoic acid IUPAC Name: 5-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonyl-2-fluorobenzoic acid Traditional Name: 5-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonyl-2-fluoro-benzoic acid Formula: C19H14FNO6S2 MolecularWeight: 435.445963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O)C(=O)C

InChI

InChI=1S/C19H14FNO6S2/c1-10-17(11(2)22)28-18(21-10)12-3-5-13(6-4-12)27-29(25,26)14-7-8-16(20)15(9-14)19(23)24/h3-9H,1-2H3,(H,23,24)