2-[(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)carbonylamino]benzoic acid

Systemtic Name: 2-[(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)carbonylamino]benzoic acid Openeye Name: 2-[(4-pyrrolidin-1-ylsulfonylthiophene-2-carbonyl)amino]benzoic acid CAS Name: 2-[[oxo-[4-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]amino]benzoic acid IUPAC Name: 2-[(4-pyrrolidin-1-ylsulfonylthiophene-2-carbonyl)amino]benzoic acid Traditional Name: 2-[(4-pyrrolidinosulfonylthiophene-2-carbonyl)amino]benzoic acid Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C16H16N2O5S2/c19-15(17-13-6-2-1-5-12(13)16(20)21)14-9-11(10-24-14)25(22,23)18-7-3-4-8-18/h1-2,5-6,9-10H,3-4,7-8H2,(H,17,19)(H,20,21)