1-butyl-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]benzimidazole-5-sulfonamide Formula: C20H23N5O2S2 MolecularWeight: 429.55892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C20H23N5O2S2/c1-3-4-9-25-18-8-6-14(29(21,26)27)11-17(18)22-19(25)12-28-20-23-15-7-5-13(2)10-16(15)24-20/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,23,24)(H2,21,26,27)