5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[(1-mesylisonipecotoyl)amino]-2-thenoic acid Formula: C12H16N2O5S2 MolecularWeight: 332.39584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C12H16N2O5S2/c1-21(18,19)14-6-4-8(5-7-14)11(15)13-10-3-2-9(20-10)12(16)17/h2-3,8H,4-7H2,1H3,(H,13,15)(H,16,17)