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

Systemtic Name: 6-methyl-5-[2-oxidanyl-3-(4-phenoxyphenoxy)propyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CC(COC4=CC=C(C=C4)OC5=CC=CC=C5)O

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CC(COC4=CC=C(C=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C27H24N4O4/c1-19-29-26-25(16-28-31(26)20-8-4-2-5-9-20)27(33)30(19)17-21(32)18-34-22-12-14-24(15-13-22)35-23-10-6-3-7-11-23/h2-16,21,32H,17-18H2,1H3