2-[2-[(3-methylsulfonylphenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(3-methylsulfonylphenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(3-methylsulfonylbenzoyl)amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(3-methylsulfonylbenzoyl)amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(3-mesylbenzoyl)amino]thiazol-4-yl]acetic acid Formula: C13H12N2O5S2 MolecularWeight: 340.37478

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C13H12N2O5S2/c1-22(19,20)10-4-2-3-8(5-10)12(18)15-13-14-9(7-21-13)6-11(16)17/h2-5,7H,6H2,1H3,(H,16,17)(H,14,15,18)