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

Systemtic Name: 3-methyl-6-(2-propoxyphenyl)-2-pyrimidin-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-methyl-6-(2-propoxyphenyl)-2-pyrimidin-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-methyl-6-(2-propoxyphenyl)-2-(2-pyrimidinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3-methyl-6-(2-propoxyphenyl)-2-pyrimidin-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-methyl-6-(2-propoxyphenyl)-2-(2-pyrimidyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H18N6O2 MolecularWeight: 362.38522

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(N(NC3=N2)C4=NC=CC=N4)C

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(N(NC3=N2)C4=NC=CC=N4)C

InChI

InChI=1S/C19H18N6O2/c1-3-11-27-14-8-5-4-7-13(14)16-22-17-15(18(26)23-16)12(2)25(24-17)19-20-9-6-10-21-19/h4-10H,3,11H2,1-2H3,(H,22,23,24,26)