N-[1,3-dimethyl-2-oxidanylidene-6-[(phenylmethyl)amino]benzimidazol-5-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[1,3-dimethyl-2-oxidanylidene-6-[(phenylmethyl)amino]benzimidazol-5-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[6-(benzylamino)-1,3-dimethyl-2-oxo-benzimidazol-5-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1,3-dimethyl-2-oxo-6-[(phenylmethyl)amino]-5-benzimidazolyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[6-(benzylamino)-1,3-dimethyl-2-oxobenzimidazol-5-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[6-(benzylamino)-2-keto-1,3-dimethyl-benzimidazol-5-yl]piazthiole-4-sulfonamide Formula: C22H20N6O3S2 MolecularWeight: 480.5626

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)NS(=O)(=O)C3=CC=CC4=NSN=C43)NCC5=CC=CC=C5

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)NS(=O)(=O)C3=CC=CC4=NSN=C43)NCC5=CC=CC=C5

InChI

InChI=1S/C22H20N6O3S2/c1-27-18-11-16(23-13-14-7-4-3-5-8-14)17(12-19(18)28(2)22(27)29)26-33(30,31)20-10-6-9-15-21(20)25-32-24-15/h3-12,23,26H,13H2,1-2H3