1-butyl-2-[[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(1-isobutyltetrazol-5-yl)sulfanylmethyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[[1-(2-methylpropyl)-5-tetrazolyl]thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[1-(2-methylpropyl)tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[(1-isobutyltetrazol-5-yl)thio]methyl]benzimidazole-5-sulfonamide Formula: C17H25N7O2S2 MolecularWeight: 423.5561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NN=NN3CC(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NN=NN3CC(C)C

InChI

InChI=1S/C17H25N7O2S2/c1-4-5-8-23-15-7-6-13(28(18,25)26)9-14(15)19-16(23)11-27-17-20-21-22-24(17)10-12(2)3/h6-7,9,12H,4-5,8,10-11H2,1-3H3,(H2,18,25,26)