2-(4-chlorophenyl)-5-(4-methylpiperazin-1-yl)-4-(4-phenylphenoxy)pyridazin-3-one chloride

Systemtic Name: 2-(4-chlorophenyl)-5-(4-methylpiperazin-1-yl)-4-(4-phenylphenoxy)pyridazin-3-one chloride Openeye Name: 2-(4-chlorophenyl)-5-(4-methylpiperazin-1-yl)-4-(4-phenylphenoxy)pyridazin-3-one chloride CAS Name: 2-(4-chlorophenyl)-5-(4-methyl-1-piperazinyl)-4-(4-phenylphenoxy)-3-pyridazinone chloride IUPAC Name: 2-(4-chlorophenyl)-5-(4-methylpiperazin-1-yl)-4-(4-phenylphenoxy)pyridazin-3-one chloride Traditional Name: 2-(4-chlorophenyl)-5-(4-methylpiperazino)-4-(4-phenylphenoxy)pyridazin-3-one chloride Formula: C27H25Cl2N4O2- MolecularWeight: 508.419

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Cl)OC4=CC=C(C=C4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Cl)OC4=CC=C(C=C4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C27H25ClN4O2.ClH/c1-30-15-17-31(18-16-30)25-19-29-32(23-11-9-22(28)10-12-23)27(33)26(25)34-24-13-7-21(8-14-24)20-5-3-2-4-6-20;/h2-14,19H,15-18H2,1H3;1H/p-1