2-[2,5-bis(chloranyl)thiophen-3-yl]-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid

Systemtic Name: 2-[2,5-bis(chloranyl)thiophen-3-yl]-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dichloro-3-thienyl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid CAS Name: 2-(2,5-dichloro-3-thiophenyl)-6-(dimethylsulfamoyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dichlorothiophen-3-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Traditional Name: 2-(2,5-dichloro-3-thienyl)-6-(dimethylsulfamoyl)cinchoninic acid Formula: C16H12Cl2N2O4S2 MolecularWeight: 431.31348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C16H12Cl2N2O4S2/c1-20(2)26(23,24)8-3-4-12-9(5-8)10(16(21)22)6-13(19-12)11-7-14(17)25-15(11)18/h3-7H,1-2H3,(H,21,22)