5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(2-chloro-6-fluoro-phenyl)methyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(2-chloro-6-fluorophenyl)methyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(2-chloro-6-fluorophenyl)methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(2-chloro-6-fluoro-benzyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H10ClFN4O MolecularWeight: 292.696103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C13H10ClFN4O/c1-18-12-8(5-17-18)13(20)19(7-16-12)6-9-10(14)3-2-4-11(9)15/h2-5,7H,6H2,1H3