ethyl 4-[[3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)quinoxalin-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)quinoxalin-2-yl]amino]benzoate Openeye Name: ethyl 4-[[3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)quinoxalin-2-yl]amino]benzoate CAS Name: 4-[[3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-2-quinoxalinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)quinoxalin-2-yl]amino]benzoate Traditional Name: 4-[[3-(piazthiol-4-ylsulfonylamino)quinoxalin-2-yl]amino]benzoic acid ethyl ester Formula: C23H18N6O4S2 MolecularWeight: 506.55682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C23H18N6O4S2/c1-2-33-23(30)14-10-12-15(13-11-14)24-21-22(26-17-7-4-3-6-16(17)25-21)29-35(31,32)19-9-5-8-18-20(19)28-34-27-18/h3-13H,2H2,1H3,(H,24,25)(H,26,29)