N2-(4-bromophenyl)-9-ethyl-purine-2,6-diamine

Systemtic Name: N2-(4-bromophenyl)-9-ethyl-purine-2,6-diamine Openeye Name: N2-(4-bromophenyl)-9-ethyl-purine-2,6-diamine CAS Name: N2-(4-bromophenyl)-9-ethylpurine-2,6-diamine IUPAC Name: 2-N-(4-bromophenyl)-9-ethylpurine-2,6-diamine Traditional Name: (6-amino-9-ethyl-purin-2-yl)-(4-bromophenyl)amine Formula: C13H13BrN6 MolecularWeight: 333.18652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2N)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2N)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C13H13BrN6/c1-2-20-7-16-10-11(15)18-13(19-12(10)20)17-9-5-3-8(14)4-6-9/h3-7H,2H2,1H3,(H3,15,17,18,19)