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

Systemtic Name: 3-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid CAS Name: 3-[(3-methylsulfonyl-1-oxopropyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-(3-mesylpropanoylamino)-2-thenoic acid Formula: C9H11NO5S2 MolecularWeight: 277.31734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(=O)NC1=C(SC=C1)C(=O)O

Isomeric SMILES

CS(=O)(=O)CCC(=O)NC1=C(SC=C1)C(=O)O

InChI

InChI=1S/C9H11NO5S2/c1-17(14,15)5-3-7(11)10-6-2-4-16-8(6)9(12)13/h2,4H,3,5H2,1H3,(H,10,11)(H,12,13)