6-(diethylsulfamoyl)-2-(2,5-dimethylthiophen-3-yl)quinoline-4-carboxylic acid

Systemtic Name: 6-(diethylsulfamoyl)-2-(2,5-dimethylthiophen-3-yl)quinoline-4-carboxylic acid Openeye Name: 6-(diethylsulfamoyl)-2-(2,5-dimethyl-3-thienyl)quinoline-4-carboxylic acid CAS Name: 6-(diethylsulfamoyl)-2-(2,5-dimethyl-3-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-(diethylsulfamoyl)-2-(2,5-dimethylthiophen-3-yl)quinoline-4-carboxylic acid Traditional Name: 6-(diethylsulfamoyl)-2-(2,5-dimethyl-3-thienyl)cinchoninic acid Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C20H22N2O4S2/c1-5-22(6-2)28(25,26)14-7-8-18-16(10-14)17(20(23)24)11-19(21-18)15-9-12(3)27-13(15)4/h7-11H,5-6H2,1-4H3,(H,23,24)