6-[2-ethoxy-5-(2-morpholin-4-ylethanoyl)phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-ethoxy-5-(2-morpholin-4-ylethanoyl)phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-ethoxy-5-(2-morpholinoacetyl)phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-ethoxy-5-[2-(4-morpholinyl)-1-oxoethyl]phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-ethoxy-5-(2-morpholin-4-ylacetyl)phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[2-ethoxy-5-(2-morpholinoacetyl)phenyl]-1-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H27N5O4 MolecularWeight: 425.48088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC(=NC(=O)C2=CN1)C3=C(C=CC(=C3)C(=O)CN4CCOCC4)OCC

Isomeric SMILES

CCCN1C2=NC(=NC(=O)C2=CN1)C3=C(C=CC(=C3)C(=O)CN4CCOCC4)OCC

InChI

InChI=1S/C22H27N5O4/c1-3-7-27-21-17(13-23-27)22(29)25-20(24-21)16-12-15(5-6-19(16)31-4-2)18(28)14-26-8-10-30-11-9-26/h5-6,12-13,23H,3-4,7-11,14H2,1-2H3