2-(1-benzothiophen-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(1-benzothiophen-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Openeye Name: 2-(benzothiophen-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid CAS Name: 2-(1-benzothiophen-2-yl)-6-(dimethylsulfamoyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(1-benzothiophen-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Traditional Name: 2-(benzothiophen-2-yl)-6-(dimethylsulfamoyl)cinchoninic acid Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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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=CC4=CC=CC=C4S3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O4S2/c1-22(2)28(25,26)13-7-8-16-14(10-13)15(20(23)24)11-17(21-16)19-9-12-5-3-4-6-18(12)27-19/h3-11H,1-2H3,(H,23,24)