2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxo-propyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[3-cyano-3-(1,3-dimethyl-2-benzimidazolylidene)-2-oxopropyl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxopropyl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-keto-propyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C23H24N6O3S2 MolecularWeight: 496.60506

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N

InChI

InChI=1S/C23H24N6O3S2/c1-4-11-29-18-10-9-15(34(25,31)32)12-17(18)26-23(29)33-14-21(30)16(13-24)22-27(2)19-7-5-6-8-20(19)28(22)3/h5-10,12H,4,11,14H2,1-3H3,(H2,25,31,32)