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

Systemtic Name: 4-(2-butoxyphenyl)-3-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(2-butoxyphenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 4-(2-butoxyphenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(2-butoxyphenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-(2-butoxyphenyl)-1-(6-keto-1H-pyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O3/c1-3-4-11-29-16-8-6-5-7-14(16)15-12-19(28)22-21-20(15)13(2)25-26(21)17-9-10-18(27)24-23-17/h5-10,15,25H,3-4,11-12H2,1-2H3,(H,24,27)