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

Systemtic Name: 6-[(3-chlorophenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3-chlorophenyl)methyl]-1-(1-ethylpropyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3-chlorophenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3-chlorophenyl)methyl]-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(3-chlorobenzyl)-1-(1-ethylpropyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H19ClN4O MolecularWeight: 330.81196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN4O/c1-3-13(4-2)22-16-14(10-19-22)17(23)21-15(20-16)9-11-6-5-7-12(18)8-11/h5-8,10,13,19H,3-4,9H2,1-2H3