6-(5-methyl-3-phenyl-pyrazol-1-yl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(5-methyl-3-phenyl-pyrazol-1-yl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(5-methyl-3-phenyl-pyrazol-1-yl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one CAS Name: 6-(5-methyl-3-phenyl-1-pyrazolyl)-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(5-methyl-3-phenylpyrazol-1-yl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 2-[2-keto-2-(4-phenylpiperazino)ethyl]-6-(5-methyl-3-phenyl-pyrazol-1-yl)pyridazin-3-one Formula: C26H26N6O2 MolecularWeight: 454.52364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N6O2/c1-20-18-23(21-8-4-2-5-9-21)27-32(20)24-12-13-25(33)31(28-24)19-26(34)30-16-14-29(15-17-30)22-10-6-3-7-11-22/h2-13,18H,14-17,19H2,1H3