5-phenethyl-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-phenethyl-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-benzyl-5-phenethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-phenethyl-1-phenyl-6-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-benzyl-5-phenethyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-benzyl-5-phenethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C26H22N4O MolecularWeight: 406.47908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O/c31-26-23-19-27-30(22-14-8-3-9-15-22)25(23)28-24(18-21-12-6-2-7-13-21)29(26)17-16-20-10-4-1-5-11-20/h1-15,19H,16-18H2