4,5-bis(chloranyl)-2-[6-(4-methylphenoxy)-2-phenyl-pyrimidin-4-yl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[6-(4-methylphenoxy)-2-phenyl-pyrimidin-4-yl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[6-(4-methylphenoxy)-2-phenyl-pyrimidin-4-yl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[6-(4-methylphenoxy)-2-phenyl-4-pyrimidinyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[6-(4-methylphenoxy)-2-phenylpyrimidin-4-yl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[6-(4-methylphenoxy)-2-phenyl-pyrimidin-4-yl]pyridazin-3-one Formula: C21H14Cl2N4O2 MolecularWeight: 425.26746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C(=O)C(=C(C=N3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C(=O)C(=C(C=N3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H14Cl2N4O2/c1-13-7-9-15(10-8-13)29-18-11-17(27-21(28)19(23)16(22)12-24-27)25-20(26-18)14-5-3-2-4-6-14/h2-12H,1H3