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

Systemtic Name: 5-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonyl-2-oxidanyl-benzoic acid Openeye Name: 5-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonyl-2-hydroxy-benzoic acid CAS Name: 5-[2-acetamido-4-(2-methyl-4-thiazolyl)phenoxy]sulfonyl-2-hydroxybenzoic acid IUPAC Name: 5-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonyl-2-hydroxybenzoic acid Traditional Name: 5-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonyl-2-hydroxy-benzoic acid Formula: C19H16N2O7S2 MolecularWeight: 448.46954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O7S2/c1-10(22)20-15-7-12(16-9-29-11(2)21-16)3-6-18(15)28-30(26,27)13-4-5-17(23)14(8-13)19(24)25/h3-9,23H,1-2H3,(H,20,22)(H,24,25)