4-(4-methoxy-3-prop-2-ynoxy-phenyl)-1-(6-methoxypyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 4-(4-methoxy-3-prop-2-ynoxy-phenyl)-1-(6-methoxypyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(4-methoxy-3-prop-2-ynoxy-phenyl)-1-(6-methoxypyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 4-(4-methoxy-3-prop-2-ynoxyphenyl)-1-(6-methoxy-3-pyridazinyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(4-methoxy-3-prop-2-ynoxyphenyl)-1-(6-methoxypyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-(4-methoxy-3-propargyloxy-phenyl)-1-(6-methoxypyridazin-3-yl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C22H21N5O4 MolecularWeight: 419.43324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NN=C(C=C3)OC)C4=CC(=C(C=C4)OC)OCC#C

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NN=C(C=C3)OC)C4=CC(=C(C=C4)OC)OCC#C

InChI

InChI=1S/C22H21N5O4/c1-5-10-31-17-11-14(6-7-16(17)29-3)15-12-19(28)23-22-21(15)13(2)26-27(22)18-8-9-20(30-4)25-24-18/h1,6-9,11,15,26H,10,12H2,2-4H3