1,3-benzothiazol-2-ylmethyl 6-(diethylsulfamoyl)-2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 6-(diethylsulfamoyl)-2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxylate CAS Name: 6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxylate Traditional Name: 6-(diethylsulfamoyl)-2-keto-1H-quinoline-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O5S2/c1-3-25(4-2)32(28,29)14-9-10-17-15(11-14)16(12-20(26)23-17)22(27)30-13-21-24-18-7-5-6-8-19(18)31-21/h5-12H,3-4,13H2,1-2H3,(H,23,26)