2-(2-phenoxyethyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyridazin-3-one

Systemtic Name: 2-(2-phenoxyethyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyridazin-3-one Openeye Name: 2-(2-phenoxyethyl)-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridazin-3-one CAS Name: 6-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-(2-phenoxyethyl)-3-pyridazinone IUPAC Name: 2-(2-phenoxyethyl)-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridazin-3-one Traditional Name: 2-(2-phenoxyethyl)-6-[4-(2-pyrimidyl)piperazine-1-carbonyl]pyridazin-3-one Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C21H22N6O3/c28-19-8-7-18(24-27(19)15-16-30-17-5-2-1-3-6-17)20(29)25-11-13-26(14-12-25)21-22-9-4-10-23-21/h1-10H,11-16H2