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

Systemtic Name: 2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-N,N,1-triethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl]sulfanyl-N,N,1-triethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]thio]-N,N,1-triethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]sulfanyl-N,N,1-triethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl]thio]-N,N,1-triethyl-benzimidazole-5-sulfonamide Formula: C24H26N6O3S2 MolecularWeight: 510.63164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N

InChI

InChI=1S/C24H26N6O3S2/c1-4-29(5-2)35(32,33)16-11-12-21-20(13-16)28-24(30(21)6-3)34-15-22(31)17(14-25)23-26-18-9-7-8-10-19(18)27-23/h7-13,26-27H,4-6,15H2,1-3H3