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

Systemtic Name: methyl 2-[4-[[2-butyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[2-butyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-butyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1-benzimidazolyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-butyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-butyl-6-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzimidazol-1-yl]methyl]phenyl]benzoic acid methyl ester Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2)C5=NNC(=O)CC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2)C5=NNC(=O)CC5

InChI

InChI=1S/C30H30N4O3/c1-3-4-9-28-31-26-15-14-22(25-16-17-29(35)33-32-25)18-27(26)34(28)19-20-10-12-21(13-11-20)23-7-5-6-8-24(23)30(36)37-2/h5-8,10-15,18H,3-4,9,16-17,19H2,1-2H3,(H,33,35)