1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4-(4-prop-2-enoxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4-(4-prop-2-enoxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(4-allyloxyphenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3-phenyl-4-(4-prop-2-enoxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4-(4-prop-2-enoxyphenyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-(4-allyloxyphenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-phenyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C3=NC(=O)CC(C3=C(N2)C4=CC=CC=C4)C5=CC=C(C=C5)OCC=C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C3=NC(=O)CC(C3=C(N2)C4=CC=CC=C4)C5=CC=C(C=C5)OCC=C)C

InChI

InChI=1S/C27H25N5O2/c1-4-14-34-21-12-10-19(11-13-21)22-16-23(33)30-26-24(22)25(20-8-6-5-7-9-20)31-32(26)27-28-17(2)15-18(3)29-27/h4-13,15,22,31H,1,14,16H2,2-3H3