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

Systemtic Name: 1-[(4-methylphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(p-tolylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-[(4-methylphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-[(4-methylphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(4-methylbenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H12N4O MolecularWeight: 240.26058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=NC=NC(=O)C3=CN2

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=NC=NC(=O)C3=CN2

InChI

InChI=1S/C13H12N4O/c1-9-2-4-10(5-3-9)7-17-12-11(6-16-17)13(18)15-8-14-12/h2-6,8,16H,7H2,1H3