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

Systemtic Name: 4-(2-butoxyphenyl)-1-(6-chloranylpyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(2-butoxyphenyl)-1-(6-chloropyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 4-(2-butoxyphenyl)-1-(6-chloro-3-pyridazinyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(2-butoxyphenyl)-1-(6-chloropyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-(2-butoxyphenyl)-1-(6-chloropyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2CC(=O)N=C3C2=C(NN3C4=NN=C(C=C4)Cl)C

Isomeric SMILES

CCCCOC1=CC=CC=C1C2CC(=O)N=C3C2=C(NN3C4=NN=C(C=C4)Cl)C

InChI

InChI=1S/C21H22ClN5O2/c1-3-4-11-29-16-8-6-5-7-14(16)15-12-19(28)23-21-20(15)13(2)26-27(21)18-10-9-17(22)24-25-18/h5-10,15,26H,3-4,11-12H2,1-2H3