3,3-dimethyl-7-phenyl-5-(phenylmethyl)pyrazolo[3,4-d]pyridazin-4-one

Systemtic Name: 3,3-dimethyl-7-phenyl-5-(phenylmethyl)pyrazolo[3,4-d]pyridazin-4-one Openeye Name: 5-benzyl-3,3-dimethyl-7-phenyl-pyrazolo[3,4-d]pyridazin-4-one CAS Name: 3,3-dimethyl-7-phenyl-5-(phenylmethyl)-4-pyrazolo[3,4-d]pyridazinone IUPAC Name: 5-benzyl-3,3-dimethyl-7-phenylpyrazolo[3,4-d]pyridazin-4-one Traditional Name: 5-benzyl-3,3-dimethyl-7-phenyl-pyrazolo[3,4-d]pyridazin-4-one Formula: C20H18N4O MolecularWeight: 330.38312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=NN(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4)N=N1)C

Isomeric SMILES

CC1(C2=C(C(=NN(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4)N=N1)C

InChI

InChI=1S/C20H18N4O/c1-20(2)16-18(21-23-20)17(15-11-7-4-8-12-15)22-24(19(16)25)13-14-9-5-3-6-10-14/h3-12H,13H2,1-2H3