4-[[2-butyl-5-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-butyl-5-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-butyl-5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-butyl-5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-butyl-5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-butyl-5-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]benzoic acid Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=CC(=C2)C4=NNC(=O)CC4C

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=CC(=C2)C4=NNC(=O)CC4C

InChI

InChI=1S/C24H26N4O3/c1-3-4-5-21-25-19-13-18(23-15(2)12-22(29)26-27-23)10-11-20(19)28(21)14-16-6-8-17(9-7-16)24(30)31/h6-11,13,15H,3-5,12,14H2,1-2H3,(H,26,29)(H,30,31)