5-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylthiophene-3-carboxylic acid

Systemtic Name: 5-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylthiophene-3-carboxylic acid Openeye Name: 5-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonylthiophene-3-carboxylic acid CAS Name: 5-[2-acetamido-4-(2-methyl-4-thiazolyl)phenoxy]sulfonyl-3-thiophenecarboxylic acid IUPAC Name: 5-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]sulfonylthiophene-3-carboxylic acid Traditional Name: 5-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]sulfonyl-3-thenoic acid Formula: C17H14N2O6S3 MolecularWeight: 438.49786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC(=CS3)C(=O)O)NC(=O)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC(=CS3)C(=O)O)NC(=O)C

InChI

InChI=1S/C17H14N2O6S3/c1-9(20)18-13-5-11(14-8-26-10(2)19-14)3-4-15(13)25-28(23,24)16-6-12(7-27-16)17(21)22/h3-8H,1-2H3,(H,18,20)(H,21,22)