2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonylamino]terephthalic acid Openeye Name: 2-[[2-(4-fluorophenyl)thiazole-4-carbonyl]amino]terephthalic acid CAS Name: 2-[[[2-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]amino]terephthalic acid Traditional Name: 2-[[2-(4-fluorophenyl)thiazole-4-carbonyl]amino]terephthalic acid Formula: C18H11FN2O5S MolecularWeight: 386.353743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O)F

InChI

InChI=1S/C18H11FN2O5S/c19-11-4-1-9(2-5-11)16-21-14(8-27-16)15(22)20-13-7-10(17(23)24)3-6-12(13)18(25)26/h1-8H,(H,20,22)(H,23,24)(H,25,26)