2-(1H-benzimidazol-2-yl)-5-tert-butyl-1H-pyrazol-3-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-5-tert-butyl-1H-pyrazol-3-one Openeye Name: 2-(1H-benzimidazol-2-yl)-5-tert-butyl-1H-pyrazol-3-one CAS Name: 2-(1H-benzimidazol-2-yl)-5-tert-butyl-1H-pyrazol-3-one IUPAC Name: 2-(1H-benzimidazol-2-yl)-5-tert-butyl-1H-pyrazol-3-one Traditional Name: 2-(1H-benzimidazol-2-yl)-5-tert-butyl-3-pyrazolin-3-one Formula: C14H16N4O MolecularWeight: 256.30304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)N(N1)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)C1=CC(=O)N(N1)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H16N4O/c1-14(2,3)11-8-12(19)18(17-11)13-15-9-6-4-5-7-10(9)16-13/h4-8,17H,1-3H3,(H,15,16)