N6-(3-chlorophenyl)-9-ethyl-N2-methyl-purine-2,6-diamine

Systemtic Name: N6-(3-chlorophenyl)-9-ethyl-N2-methyl-purine-2,6-diamine Openeye Name: N6-(3-chlorophenyl)-9-ethyl-N2-methyl-purine-2,6-diamine CAS Name: N6-(3-chlorophenyl)-9-ethyl-N2-methylpurine-2,6-diamine IUPAC Name: 6-N-(3-chlorophenyl)-9-ethyl-2-N-methylpurine-2,6-diamine Traditional Name: [6-(3-chloroanilino)-9-ethyl-purin-2-yl]-methyl-amine Formula: C14H15ClN6 MolecularWeight: 302.7621

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NC

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NC

InChI

InChI=1S/C14H15ClN6/c1-3-21-8-17-11-12(19-14(16-2)20-13(11)21)18-10-6-4-5-9(15)7-10/h4-8H,3H2,1-2H3,(H2,16,18,19,20)