1-cyclopentyl-6-[[2-(trifluoromethyloxy)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-cyclopentyl-6-[[2-(trifluoromethyloxy)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-cyclopentyl-6-[[2-(trifluoromethoxy)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-cyclopentyl-6-[[2-(trifluoromethoxy)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-cyclopentyl-6-[[2-(trifluoromethoxy)phenyl]methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-cyclopentyl-6-[2-(trifluoromethoxy)benzyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H17F3N4O2 MolecularWeight: 378.34839

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=NC(=NC(=O)C3=CN2)CC4=CC=CC=C4OC(F)(F)F

Isomeric SMILES

C1CCC(C1)N2C3=NC(=NC(=O)C3=CN2)CC4=CC=CC=C4OC(F)(F)F

InChI

InChI=1S/C18H17F3N4O2/c19-18(20,21)27-14-8-4-1-5-11(14)9-15-23-16-13(17(26)24-15)10-22-25(16)12-6-2-3-7-12/h1,4-5,8,10,12,22H,2-3,6-7,9H2