N-[3-[(4-chloranyl-3-nitro-phenyl)amino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-[(4-chloranyl-3-nitro-phenyl)amino]quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-(4-chloro-3-nitro-anilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-(4-chloro-3-nitroanilino)-2-quinoxalinyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-(4-chloro-3-nitroanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-(4-chloro-3-nitro-anilino)quinoxalin-2-yl]piazthiole-4-sulfonamide Formula: C20H12ClN7O4S2 MolecularWeight: 513.93678

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=CC4=NSN=C43)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC4=NSN=C43)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H12ClN7O4S2/c21-12-9-8-11(10-16(12)28(29)30)22-19-20(24-14-5-2-1-4-13(14)23-19)27-34(31,32)17-7-3-6-15-18(17)26-33-25-15/h1-10H,(H,22,23)(H,24,27)