4-[[4,6-bis(chloranyl)-1H-benzimidazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[4,6-bis(chloranyl)-1H-benzimidazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(4,6-dichloro-1H-benzimidazol-2-yl)sulfanyl]-3-nitro-benzenesulfonamide CAS Name: 4-[(4,6-dichloro-1H-benzimidazol-2-yl)thio]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(4,6-dichloro-1H-benzimidazol-2-yl)sulfanyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(4,6-dichloro-1H-benzimidazol-2-yl)thio]-3-nitro-benzenesulfonamide Formula: C13H8Cl2N4O4S2 MolecularWeight: 419.26302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])SC2=NC3=C(C=C(C=C3N2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])SC2=NC3=C(C=C(C=C3N2)Cl)Cl

InChI

InChI=1S/C13H8Cl2N4O4S2/c14-6-3-8(15)12-9(4-6)17-13(18-12)24-11-2-1-7(25(16,22)23)5-10(11)19(20)21/h1-5H,(H,17,18)(H2,16,22,23)