2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-diethyl-1-(2-furylmethyl)benzimidazole-5-sulfonamide CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-N,N-diethyl-1-(2-furanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-N,N-diethyl-1-(2-furfuryl)benzimidazole-5-sulfonamide Formula: C25H26ClN3O5S2 MolecularWeight: 548.07404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C4C(=CC(=C3)Cl)COCO4)CC5=CC=CO5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C4C(=CC(=C3)Cl)COCO4)CC5=CC=CO5

InChI

InChI=1S/C25H26ClN3O5S2/c1-3-28(4-2)36(30,31)21-7-8-23-22(12-21)27-25(29(23)13-20-6-5-9-33-20)35-15-18-11-19(26)10-17-14-32-16-34-24(17)18/h5-12H,3-4,13-16H2,1-2H3