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

Systemtic Name: 1-butyl-2-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[[1-(4-hydroxyphenyl)-5-tetrazolyl]thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[[1-(4-hydroxyphenyl)tetrazol-5-yl]thio]methyl]benzimidazole-5-sulfonamide Formula: C19H21N7O3S2 MolecularWeight: 459.54514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NN=NN3C4=CC=C(C=C4)O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NN=NN3C4=CC=C(C=C4)O

InChI

InChI=1S/C19H21N7O3S2/c1-2-3-10-25-17-9-8-15(31(20,28)29)11-16(17)21-18(25)12-30-19-22-23-24-26(19)13-4-6-14(27)7-5-13/h4-9,11,27H,2-3,10,12H2,1H3,(H2,20,28,29)