1-(6-chloranylpyridazin-3-yl)-3-methyl-4-(3-pyrimidin-2-yloxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-3-methyl-4-(3-pyrimidin-2-yloxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 1-(6-chloropyridazin-3-yl)-3-methyl-4-(3-pyrimidin-2-yloxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 1-(6-chloro-3-pyridazinyl)-3-methyl-4-[3-(2-pyrimidinyloxy)phenyl]-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 1-(6-chloropyridazin-3-yl)-3-methyl-4-(3-pyrimidin-2-yloxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 1-(6-chloropyridazin-3-yl)-3-methyl-4-[3-(2-pyrimidyloxy)phenyl]-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C21H16ClN7O2 MolecularWeight: 433.85044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NN=C(C=C3)Cl)C4=CC(=CC=C4)OC5=NC=CC=N5

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NN=C(C=C3)Cl)C4=CC(=CC=C4)OC5=NC=CC=N5

InChI

InChI=1S/C21H16ClN7O2/c1-12-19-15(13-4-2-5-14(10-13)31-21-23-8-3-9-24-21)11-18(30)25-20(19)29(28-12)17-7-6-16(22)26-27-17/h2-10,15,28H,11H2,1H3