5-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)O

InChI

InChI=1S/C23H24N4O3/c1-15-9-10-16(2)21(11-15)30-14-19(28)13-26-17(3)25-22-20(23(26)29)12-24-27(22)18-7-5-4-6-8-18/h4-12,19,28H,13-14H2,1-3H3