5-(3-methoxyphenyl)-3-(pyrimidin-2-ylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one

Systemtic Name: 5-(3-methoxyphenyl)-3-(pyrimidin-2-ylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one Openeye Name: 5-(3-methoxyphenyl)-3-(pyrimidin-2-ylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one CAS Name: 5-(3-methoxyphenyl)-3-(2-pyrimidinylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one IUPAC Name: 5-(3-methoxyphenyl)-3-(pyrimidin-2-ylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one Traditional Name: 5-(3-methoxyphenyl)-3-(2-pyrimidylamino)-1H-pyrazolo[4,3-c]pyridazin-6-one Formula: C16H13N7O2 MolecularWeight: 335.32012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C=C3C(=N2)C(=NN3)NC4=NC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C=C3C(=N2)C(=NN3)NC4=NC=CC=N4

InChI

InChI=1S/C16H13N7O2/c1-25-11-5-2-4-10(8-11)23-13(24)9-12-14(22-23)15(21-20-12)19-16-17-6-3-7-18-16/h2-9,20H,1H3,(H,17,18,19,21)