4,5-dimethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylic acid Openeye Name: 4,5-dimethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-[(3-methylsulfonyl-1-oxopropyl)amino]-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylic acid Traditional Name: 2-(3-mesylpropanoylamino)-4,5-dimethyl-3-thenoic acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)CCS(=O)(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)CCS(=O)(=O)C)C

InChI

InChI=1S/C11H15NO5S2/c1-6-7(2)18-10(9(6)11(14)15)12-8(13)4-5-19(3,16)17/h4-5H2,1-3H3,(H,12,13)(H,14,15)