9-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-prop-2-enyl-purin-6-amine

Systemtic Name: 9-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-prop-2-enyl-purin-6-amine Openeye Name: N-allyl-9-[(2-chloro-6-fluoro-phenyl)methyl]purin-6-amine CAS Name: 9-[(2-chloro-6-fluorophenyl)methyl]-N-prop-2-enyl-6-purinamine IUPAC Name: 9-[(2-chloro-6-fluorophenyl)methyl]-N-prop-2-enylpurin-6-amine Traditional Name: allyl-[9-(2-chloro-6-fluoro-benzyl)purin-6-yl]amine Formula: C15H13ClFN5 MolecularWeight: 317.748623

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC=NC2=C1N=CN2CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C=CCNC1=NC=NC2=C1N=CN2CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C15H13ClFN5/c1-2-6-18-14-13-15(20-8-19-14)22(9-21-13)7-10-11(16)4-3-5-12(10)17/h2-5,8-9H,1,6-7H2,(H,18,19,20)