7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one

Systemtic Name: 7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one Openeye Name: 7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one CAS Name: 7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one IUPAC Name: 7-[(2-fluorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one Traditional Name: 7-(2-fluorobenzyl)-2-(methylaminomethyl)-3H-purin-6-one Formula: C14H14FN5O MolecularWeight: 287.292263

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3F

Isomeric SMILES

CNCC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3F

InChI

InChI=1S/C14H14FN5O/c1-16-6-11-18-13-12(14(21)19-11)20(8-17-13)7-9-4-2-3-5-10(9)15/h2-5,8,16H,6-7H2,1H3,(H,18,19,21)