3-[oxidanyl(pyrimidin-2-yl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3-[oxidanyl(pyrimidin-2-yl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-[hydroxy(pyrimidin-2-yl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-[hydroxy(2-pyrimidinyl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3-[hydroxy(pyrimidin-2-yl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-[hydroxy(2-pyrimidyl)methyl]-6-(2-propoxyphenyl)-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H24N6O3 MolecularWeight: 420.46436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC(=NC(=O)C2=C(N1)C(C3=NC=CC=N3)O)C4=CC=CC=C4OCCC

Isomeric SMILES

CCCN1C2=NC(=NC(=O)C2=C(N1)C(C3=NC=CC=N3)O)C4=CC=CC=C4OCCC

InChI

InChI=1S/C22H24N6O3/c1-3-12-28-21-16(17(27-28)18(29)20-23-10-7-11-24-20)22(30)26-19(25-21)14-8-5-6-9-15(14)31-13-4-2/h5-11,18,27,29H,3-4,12-13H2,1-2H3