4-azanyl-6-[(4-methylpiperazin-1-yl)methyl]-2-(phenylmethyl)-5-(3-phenyl-1H-pyrazol-5-yl)pyridazin-3-one

Systemtic Name: 4-azanyl-6-[(4-methylpiperazin-1-yl)methyl]-2-(phenylmethyl)-5-(3-phenyl-1H-pyrazol-5-yl)pyridazin-3-one Openeye Name: 4-amino-2-benzyl-6-[(4-methylpiperazin-1-yl)methyl]-5-(3-phenyl-1H-pyrazol-5-yl)pyridazin-3-one CAS Name: 4-amino-6-[(4-methyl-1-piperazinyl)methyl]-2-(phenylmethyl)-5-(3-phenyl-1H-pyrazol-5-yl)-3-pyridazinone IUPAC Name: 4-amino-2-benzyl-6-[(4-methylpiperazin-1-yl)methyl]-5-(3-phenyl-1H-pyrazol-5-yl)pyridazin-3-one Traditional Name: 4-amino-2-benzyl-6-[(4-methylpiperazino)methyl]-5-(3-phenyl-1H-pyrazol-5-yl)pyridazin-3-one Formula: C26H29N7O MolecularWeight: 455.55476

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NN(C(=O)C(=C2C3=CC(=NN3)C4=CC=CC=C4)N)CC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CC2=NN(C(=O)C(=C2C3=CC(=NN3)C4=CC=CC=C4)N)CC5=CC=CC=C5

InChI

InChI=1S/C26H29N7O/c1-31-12-14-32(15-13-31)18-23-24(22-16-21(28-29-22)20-10-6-3-7-11-20)25(27)26(34)33(30-23)17-19-8-4-2-5-9-19/h2-11,16H,12-15,17-18,27H2,1H3,(H,28,29)