6-cyclopentylsulfanyl-1-[(4-fluorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-cyclopentylsulfanyl-1-[(4-fluorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-cyclopentylsulfanyl-1-[(4-fluorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(cyclopentylthio)-1-[(4-fluorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-cyclopentylsulfanyl-1-[(4-fluorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(cyclopentylthio)-1-(4-fluorobenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H17FN4OS MolecularWeight: 344.406483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=NC(=O)C3=CNN(C3=N2)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C1)SC2=NC(=O)C3=CNN(C3=N2)CC4=CC=C(C=C4)F

InChI

InChI=1S/C17H17FN4OS/c18-12-7-5-11(6-8-12)10-22-15-14(9-19-22)16(23)21-17(20-15)24-13-3-1-2-4-13/h5-9,13,19H,1-4,10H2