1-ethyl-2-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[1-(1H-indol-3-yl)-1-oxopropan-2-yl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[1-(1H-indol-3-yl)-1-oxopropan-2-yl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]thio]benzimidazole-5-sulfonamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H20N4O3S2/c1-3-24-18-9-8-13(29(21,26)27)10-17(18)23-20(24)28-12(2)19(25)15-11-22-16-7-5-4-6-14(15)16/h4-12,22H,3H2,1-2H3,(H2,21,26,27)