3-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylbenzoic acid

Systemtic Name: 3-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylbenzoic acid Openeye Name: 3-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonylbenzoic acid CAS Name: 3-[2-acetamido-4-(2-methyl-4-thiazolyl)phenoxy]sulfonylbenzoic acid IUPAC Name: 3-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylbenzoic acid Traditional Name: 3-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonylbenzoic acid Formula: C19H16N2O6S2 MolecularWeight: 432.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O)NC(=O)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O)NC(=O)C

InChI

InChI=1S/C19H16N2O6S2/c1-11(22)20-16-9-13(17-10-28-12(2)21-17)6-7-18(16)27-29(25,26)15-5-3-4-14(8-15)19(23)24/h3-10H,1-2H3,(H,20,22)(H,23,24)