2-[4-(thiophen-2-ylsulfonylamino)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-(thiophen-2-ylsulfonylamino)phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-(2-thienylsulfonylamino)phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-(thiophen-2-ylsulfonylamino)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-(thiophen-2-ylsulfonylamino)phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-(2-thienylsulfonylamino)phenyl]cinchoninic acid Formula: C20H14N2O4S2 MolecularWeight: 410.46616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C20H14N2O4S2/c23-20(24)16-12-18(21-17-5-2-1-4-15(16)17)13-7-9-14(10-8-13)22-28(25,26)19-6-3-11-27-19/h1-12,22H,(H,23,24)