4,5-dimethyl-2-[(3-methylsulfonylphenyl)carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-[(3-methylsulfonylphenyl)carbonylamino]thiophene-3-carboxylic acid Openeye Name: 4,5-dimethyl-2-[(3-methylsulfonylbenzoyl)amino]thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-[(3-methylsulfonylbenzoyl)amino]thiophene-3-carboxylic acid Traditional Name: 2-[(3-mesylbenzoyl)amino]-4,5-dimethyl-3-thenoic acid Formula: C15H15NO5S2 MolecularWeight: 353.4133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C

InChI

InChI=1S/C15H15NO5S2/c1-8-9(2)22-14(12(8)15(18)19)16-13(17)10-5-4-6-11(7-10)23(3,20)21/h4-7H,1-3H3,(H,16,17)(H,18,19)