3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-amine

Systemtic Name: 3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-amine Openeye Name: 3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-amine CAS Name: 3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-amine IUPAC Name: 3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-amine Traditional Name: [3-(4-methoxyphenyl)-1H-[1,2,4]triazolo[3,4-f]purin-5-yl]amine Formula: C13H11N7O MolecularWeight: 281.27274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC3=C4C(=NC=N4)N=C(N32)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC3=C4C(=NC=N4)N=C(N32)N

InChI

InChI=1S/C13H11N7O/c1-21-8-4-2-7(3-5-8)11-18-19-12-9-10(16-6-15-9)17-13(14)20(11)12/h2-6,19H,1H3,(H2,14,15,16,17)