4-chloranyl-2-phenyl-5-[4-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 5-[4-(1-benzylpyrazole-4-carbonyl)piperazin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-(1-benzylpyrazole-4-carbonyl)piperazin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[4-(1-benzylpyrazole-4-carbonyl)piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C25H23ClN6O2 MolecularWeight: 474.94212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CN(N=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CN(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H23ClN6O2/c26-23-22(16-28-32(25(23)34)21-9-5-2-6-10-21)29-11-13-30(14-12-29)24(33)20-15-27-31(18-20)17-19-7-3-1-4-8-19/h1-10,15-16,18H,11-14,17H2