6-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-6-[4-(2-methylpropanoyl)piperazine-1-carbonyl]pyridazin-3-one CAS Name: 6-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-[4-(2-methylpropanoyl)piperazine-1-carbonyl]pyridazin-3-one Traditional Name: 2-benzyl-6-(4-isobutyrylpiperazine-1-carbonyl)pyridazin-3-one Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N4O3/c1-15(2)19(26)22-10-12-23(13-11-22)20(27)17-8-9-18(25)24(21-17)14-16-6-4-3-5-7-16/h3-9,15H,10-14H2,1-2H3