1-butyl-2-[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-(2-indolin-1-yl-1-methyl-2-oxo-ethyl)sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(2-indolin-1-yl-2-keto-1-methyl-ethyl)thio]benzimidazole-5-sulfonamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O3S2/c1-3-4-12-26-20-10-9-17(31(23,28)29)14-18(20)24-22(26)30-15(2)21(27)25-13-11-16-7-5-6-8-19(16)25/h5-10,14-15H,3-4,11-13H2,1-2H3,(H2,23,28,29)