2-[iodanyl(phenyl)methyl]-9-methyl-purin-6-amine

Systemtic Name: 2-[iodanyl(phenyl)methyl]-9-methyl-purin-6-amine Openeye Name: 2-[iodo(phenyl)methyl]-9-methyl-purin-6-amine CAS Name: 2-[iodo(phenyl)methyl]-9-methyl-6-purinamine IUPAC Name: 2-[iodo(phenyl)methyl]-9-methylpurin-6-amine Traditional Name: [2-[iodo(phenyl)methyl]-9-methyl-purin-6-yl]amine Formula: C13H12IN5 MolecularWeight: 365.17235

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=C(N=C2N)C(C3=CC=CC=C3)I

Isomeric SMILES

CN1C=NC2=C1N=C(N=C2N)C(C3=CC=CC=C3)I

InChI

InChI=1S/C13H12IN5/c1-19-7-16-10-11(15)17-12(18-13(10)19)9(14)8-5-3-2-4-6-8/h2-7,9H,1H3,(H2,15,17,18)