5-butyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-butyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-butyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-butyl-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-butyl-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-butyl-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C

Isomeric SMILES

CCCCN1C(=NC2=C(C1=O)C=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C16H18N4O/c1-3-4-10-19-12(2)18-15-14(16(19)21)11-17-20(15)13-8-6-5-7-9-13/h5-9,11H,3-4,10H2,1-2H3