5-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one

Systemtic Name: 5-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one Openeye Name: 5-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one CAS Name: 5-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one IUPAC Name: 5-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one Traditional Name: 5-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(4-methoxyphenyl)-1H-pyridazin-6-one Formula: C27H22N4O2 MolecularWeight: 434.48918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=O)C(=C2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=O)C(=C2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O2/c1-33-24-14-12-19(13-15-24)25-17-21(27(32)29-28-25)16-22-18-31(23-10-6-3-7-11-23)30-26(22)20-8-4-2-5-9-20/h2-15,17-18H,16H2,1H3,(H,29,32)