[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C23H19N3O5S2 MolecularWeight: 481.54406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C23H19N3O5S2/c1-14(22(27)25-15-6-4-7-16(12-15)33(24,29)30)31-23(28)18-13-20(21-10-5-11-32-21)26-19-9-3-2-8-17(18)19/h2-14H,1H3,(H,25,27)(H2,24,29,30)