2-(4-bromophenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(4-bromophenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(4-bromophenyl)-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4,5-dihydropyridazin-3-one CAS Name: 2-(4-bromophenyl)-6-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(4-bromophenyl)-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4,5-dihydropyridazin-3-one Traditional Name: 2-(4-bromophenyl)-6-[4-(2-pyrimidyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C19H19BrN6O2 MolecularWeight: 443.29716

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H19BrN6O2/c20-14-2-4-15(5-3-14)26-17(27)7-6-16(23-26)18(28)24-10-12-25(13-11-24)19-21-8-1-9-22-19/h1-5,8-9H,6-7,10-13H2