9-[(5-chloranyl-2-fluoranyl-phenyl)methyl]purin-6-amine

Systemtic Name: 9-[(5-chloranyl-2-fluoranyl-phenyl)methyl]purin-6-amine Openeye Name: 9-[(5-chloro-2-fluoro-phenyl)methyl]purin-6-amine CAS Name: 9-[(5-chloro-2-fluorophenyl)methyl]-6-purinamine IUPAC Name: 9-[(5-chloro-2-fluorophenyl)methyl]purin-6-amine Traditional Name: [9-(5-chloro-2-fluoro-benzyl)purin-6-yl]amine Formula: C12H9ClFN5 MolecularWeight: 277.684763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CN2C=NC3=C2N=CN=C3N)F

Isomeric SMILES

C1=CC(=C(C=C1Cl)CN2C=NC3=C2N=CN=C3N)F

InChI

InChI=1S/C12H9ClFN5/c13-8-1-2-9(14)7(3-8)4-19-6-18-10-11(15)16-5-17-12(10)19/h1-3,5-6H,4H2,(H2,15,16,17)