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

Systemtic Name: 6-[(3-methylphenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(1-ethylpropyl)-6-(m-tolylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3-methylphenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3-methylphenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(1-ethylpropyl)-6-(3-methylbenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H22N4O MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=NC(=NC(=O)C2=CN1)CC3=CC=CC(=C3)C

Isomeric SMILES

CCC(CC)N1C2=NC(=NC(=O)C2=CN1)CC3=CC=CC(=C3)C

InChI

InChI=1S/C18H22N4O/c1-4-14(5-2)22-17-15(11-19-22)18(23)21-16(20-17)10-13-8-6-7-12(3)9-13/h6-9,11,14,19H,4-5,10H2,1-3H3