3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-purin-6-amine

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-purin-6-amine Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl]-N-methyl-purin-6-amine CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-6-purinamine IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-N-methylpurin-6-amine Traditional Name: [3-(2-chloro-6-fluoro-benzyl)purin-6-yl]-methyl-amine Formula: C13H11ClFN5 MolecularWeight: 291.711343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C2C(=NC=N2)N(C=N1)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CNC1=C2C(=NC=N2)N(C=N1)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C13H11ClFN5/c1-16-12-11-13(18-6-17-11)20(7-19-12)5-8-9(14)3-2-4-10(8)15/h2-4,6-7,16H,5H2,1H3