2-[[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phenol

Systemtic Name: 2-[[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phenol Openeye Name: 2-[[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phenol CAS Name: 2-[[4-(1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]phenol IUPAC Name: 2-[[4-(1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phenol Traditional Name: 2-[[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]phenol Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)CC5=CC=CC=C5O

Isomeric SMILES

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)CC5=CC=CC=C5O

InChI

InChI=1S/C25H28N6O/c1-2-8-23-27-24(21-17-26-31(25(21)28-23)20-10-4-3-5-11-20)30-15-13-29(14-16-30)18-19-9-6-7-12-22(19)32/h3-7,9-12,17,32H,2,8,13-16,18H2,1H3