2-[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfonyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfonyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(2-methylthiazol-4-yl)methylsulfonyl]phenyl]acetic acid CAS Name: 2-[4-[(2-methyl-4-thiazolyl)methylsulfonyl]phenyl]acetic acid IUPAC Name: 2-[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfonyl]phenyl]acetic acid Traditional Name: 2-[4-[(2-methylthiazol-4-yl)methylsulfonyl]phenyl]acetic acid Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC1=NC(=CS1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C13H13NO4S2/c1-9-14-11(7-19-9)8-20(17,18)12-4-2-10(3-5-12)6-13(15)16/h2-5,7H,6,8H2,1H3,(H,15,16)