6-[2-(2-fluoranylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-(2-fluoranylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-(2-fluorophenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-(2-fluorophenoxy)ethylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-(2-fluorophenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[2-(2-fluorophenoxy)ethylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H15FN4O2S MolecularWeight: 382.411403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCCOC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCCOC4=CC=CC=C4F

InChI

InChI=1S/C19H15FN4O2S/c20-15-8-4-5-9-16(15)26-10-11-27-19-22-17-14(18(25)23-19)12-21-24(17)13-6-2-1-3-7-13/h1-9,12,21H,10-11H2