N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-N-[3-(piazthiol-5-ylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C20H13N7O4S2 MolecularWeight: 479.49172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])NC4=CC5=NSN=C5C=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])NC4=CC5=NSN=C5C=C4

InChI

InChI=1S/C20H13N7O4S2/c28-27(29)13-4-3-5-14(11-13)33(30,31)26-20-19(22-15-6-1-2-7-16(15)23-20)21-12-8-9-17-18(10-12)25-32-24-17/h1-11H,(H,21,22)(H,23,26)