3-methyl-5-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[(3-methylsulfonyl-1-oxopropyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid Traditional Name: 5-(3-mesylpropanoylamino)-3-methyl-2-thenoic acid Formula: C10H13NO5S2 MolecularWeight: 291.34392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C10H13NO5S2/c1-6-5-8(17-9(6)10(13)14)11-7(12)3-4-18(2,15)16/h5H,3-4H2,1-2H3,(H,11,12)(H,13,14)