2-(2,5-dimethylphenyl)-6-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(2,5-dimethylphenyl)-6-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(2,5-dimethylphenyl)-6-[4-(2-methylpropanoyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(2,5-dimethylphenyl)-6-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(2,5-dimethylphenyl)-6-[4-(2-methylpropanoyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(2,5-dimethylphenyl)-6-(4-isobutyrylpiperazine-1-carbonyl)-4,5-dihydropyridazin-3-one Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C21H28N4O3/c1-14(2)20(27)23-9-11-24(12-10-23)21(28)17-7-8-19(26)25(22-17)18-13-15(3)5-6-16(18)4/h5-6,13-14H,7-12H2,1-4H3