2,1,3-benzothiadiazol-4-ylsulfonyl-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)azanide

Systemtic Name: 2,1,3-benzothiadiazol-4-ylsulfonyl-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)azanide Openeye Name: 2,1,3-benzothiadiazol-4-ylsulfonyl-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxo-benzimidazol-5-yl)azanide CAS Name: 2,1,3-benzothiadiazol-4-ylsulfonyl-[6-(cyclohexylthio)-1,3-dimethyl-2-oxo-5-benzimidazolyl]azanide IUPAC Name: 2,1,3-benzothiadiazol-4-ylsulfonyl-(6-cyclohexylsulfanyl-1,3-dimethyl-2-oxobenzimidazol-5-yl)azanide Traditional Name: [6-(cyclohexylthio)-2-keto-1,3-dimethyl-benzimidazol-5-yl]-piazthiol-4-ylsulfonyl-azanide Formula: C21H22N5O3S3- MolecularWeight: 488.62608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C(=C2)[N-]S(=O)(=O)C3=CC=CC4=NSN=C43)SC5CCCCC5)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C(=C2)[N-]S(=O)(=O)C3=CC=CC4=NSN=C43)SC5CCCCC5)N(C1=O)C

InChI

InChI=1S/C21H22N5O3S3/c1-25-16-11-15(24-32(28,29)19-10-6-9-14-20(19)23-31-22-14)18(12-17(16)26(2)21(25)27)30-13-7-4-3-5-8-13/h6,9-13H,3-5,7-8H2,1-2H3/q-1