2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-butyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-butyl-benzimidazole-5-sulfonamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-butyl-benzimidazole-5-sulfonamide CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1-butyl-5-benzimidazolesulfonamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-butylbenzimidazole-5-sulfonamide Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1-butyl-benzimidazole-5-sulfonamide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H21N5O2S2/c1-2-3-10-24-17-9-8-13(28(20,25)26)11-16(17)21-18(24)12-27-19-22-14-6-4-5-7-15(14)23-19/h4-9,11H,2-3,10,12H2,1H3,(H,22,23)(H2,20,25,26)