2-(2-methylpropyl)-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-(2-methylpropyl)-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 4-(4-benzylpiperazine-1-carbonyl)-2-isobutyl-phthalazin-1-one CAS Name: 2-(2-methylpropyl)-4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 4-(4-benzylpiperazine-1-carbonyl)-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 4-(4-benzylpiperazine-1-carbonyl)-2-isobutyl-phthalazin-1-one Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2/c1-18(2)16-28-23(29)21-11-7-6-10-20(21)22(25-28)24(30)27-14-12-26(13-15-27)17-19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3