1-(1-adamantyl)-2-[[5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl]oxy]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[[5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl]oxy]ethanone Openeye Name: 1-(1-adamantyl)-2-[[5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl]oxy]ethanone CAS Name: 1-(1-adamantyl)-2-[[5-(2-benzimidazolylidene)-1,2-dihydropyrazol-3-yl]oxy]ethanone IUPAC Name: 1-(1-adamantyl)-2-[[5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl]oxy]ethanone Traditional Name: 1-(1-adamantyl)-2-[[5-(benzimidazol-2-ylidene)-3-pyrazolin-3-yl]oxy]ethanone Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC4=CC(=C5N=C6C=CC=CC6=N5)NN4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC4=CC(=C5N=C6C=CC=CC6=N5)NN4

InChI

InChI=1S/C22H24N4O2/c27-19(22-9-13-5-14(10-22)7-15(6-13)11-22)12-28-20-8-18(25-26-20)21-23-16-3-1-2-4-17(16)24-21/h1-4,8,13-15,25-26H,5-7,9-12H2