N-(2,1,3-benzothiadiazol-4-yl)-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide CAS Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]thio]-N-(2,1,3-benzothiadiazol-4-yl)acetamide IUPAC Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide Traditional Name: 2-[(3-besyl-1H-benzimidazol-3-ium-2-yl)thio]-N-piazthiol-4-yl-acetamide Formula: C21H16N5O3S3+ MolecularWeight: 482.57844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)[N+]2=C(NC3=CC=CC=C32)SCC(=O)NC4=CC=CC5=NSN=C54

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)[N+]2=C(NC3=CC=CC=C32)SCC(=O)NC4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H15N5O3S3/c27-19(22-16-10-6-11-17-20(16)25-31-24-17)13-30-21-23-15-9-4-5-12-18(15)26(21)32(28,29)14-7-2-1-3-8-14/h1-12H,13H2,(H,22,24,27)/p+1