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

Systemtic Name: 4-(3-methoxy-4-propoxy-phenyl)-3-methyl-1-(6-oxidanylidene-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(3-methoxy-4-propoxy-phenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 4-(3-methoxy-4-propoxyphenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(3-methoxy-4-propoxyphenyl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 1-(6-keto-1H-pyridazin-3-yl)-4-(3-methoxy-4-propoxy-phenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C21H23N5O4 MolecularWeight: 409.43842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2CC(=O)N=C3C2=C(NN3C4=NNC(=O)C=C4)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2CC(=O)N=C3C2=C(NN3C4=NNC(=O)C=C4)C)OC

InChI

InChI=1S/C21H23N5O4/c1-4-9-30-15-6-5-13(10-16(15)29-3)14-11-19(28)22-21-20(14)12(2)25-26(21)17-7-8-18(27)24-23-17/h5-8,10,14,25H,4,9,11H2,1-3H3,(H,24,27)