1-butyl-2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-(indan-5-ylsulfanylmethyl)benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(2,3-dihydro-1H-inden-5-ylthio)methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(indan-5-ylthio)methyl]benzimidazole-5-sulfonamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H25N3O2S2/c1-2-3-11-24-20-10-9-18(28(22,25)26)13-19(20)23-21(24)14-27-17-8-7-15-5-4-6-16(15)12-17/h7-10,12-13H,2-6,11,14H2,1H3,(H2,22,25,26)