2-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-6-phenylpyridazin-3-one Traditional Name: 2-[4-(4-benzylpiperazino)-4-keto-butyl]-6-phenyl-pyridazin-3-one Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c30-24(28-18-16-27(17-19-28)20-21-8-3-1-4-9-21)12-7-15-29-25(31)14-13-23(26-29)22-10-5-2-6-11-22/h1-6,8-11,13-14H,7,12,15-20H2