4-chloranyl-5-[4-(diphenylmethyl)piperazin-1-yl]-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-(diphenylmethyl)piperazin-1-yl]-2-(phenylmethyl)pyridazin-3-one Openeye Name: 5-(4-benzhydrylpiperazin-1-yl)-2-benzyl-4-chloro-pyridazin-3-one CAS Name: 4-chloro-5-[4-(diphenylmethyl)-1-piperazinyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 5-(4-benzhydrylpiperazin-1-yl)-2-benzyl-4-chloropyridazin-3-one Traditional Name: 5-(4-benzhydrylpiperazino)-2-benzyl-4-chloro-pyridazin-3-one Formula: C28H27ClN4O MolecularWeight: 470.99318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27ClN4O/c29-26-25(20-30-33(28(26)34)21-22-10-4-1-5-11-22)31-16-18-32(19-17-31)27(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,20,27H,16-19,21H2