N6-(2,4-dimethoxyphenyl)-7H-purine-2,6-diamine

Systemtic Name: N6-(2,4-dimethoxyphenyl)-7H-purine-2,6-diamine Openeye Name: N6-(2,4-dimethoxyphenyl)-7H-purine-2,6-diamine CAS Name: N6-(2,4-dimethoxyphenyl)-7H-purine-2,6-diamine IUPAC Name: 6-N-(2,4-dimethoxyphenyl)-7H-purine-2,6-diamine Traditional Name: (2-amino-7H-purin-6-yl)-(2,4-dimethoxyphenyl)amine Formula: C13H14N6O2 MolecularWeight: 286.28926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC(=NC3=C2NC=N3)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC(=NC3=C2NC=N3)N)OC

InChI

InChI=1S/C13H14N6O2/c1-20-7-3-4-8(9(5-7)21-2)17-12-10-11(16-6-15-10)18-13(14)19-12/h3-6H,1-2H3,(H4,14,15,16,17,18,19)