1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-3-methyl-6-[5-(5-phenyl-1H-1,2,4-triazol-3-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H25N7O2 MolecularWeight: 455.5117

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC=CC=C3)C4=NC(=O)C5=C(NN(C5=N4)CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC=CC=C3)C4=NC(=O)C5=C(NN(C5=N4)CC)C

InChI

InChI=1S/C25H25N7O2/c1-4-13-34-19-12-11-17(22-26-21(29-30-22)16-9-7-6-8-10-16)14-18(19)23-27-24-20(25(33)28-23)15(3)31-32(24)5-2/h6-12,14,31H,4-5,13H2,1-3H3,(H,26,29,30)