N,N,1-triethyl-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: N,N,1-triethyl-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: N,N,1-triethyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: N,N,1-triethyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: N,N,1-triethyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: N,N,1-triethyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]benzimidazole-5-sulfonamide Formula: C22H26FN3O4S2 MolecularWeight: 479.587943

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=C4C(=CC(=C3)F)COCO4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=C4C(=CC(=C3)F)COCO4

InChI

InChI=1S/C22H26FN3O4S2/c1-4-25(5-2)32(27,28)18-7-8-20-19(11-18)24-22(26(20)6-3)31-13-16-10-17(23)9-15-12-29-14-30-21(15)16/h7-11H,4-6,12-14H2,1-3H3