N6-(1,3-benzodioxol-5-yl)-7H-purine-2,6-diamine

Systemtic Name: N6-(1,3-benzodioxol-5-yl)-7H-purine-2,6-diamine Openeye Name: N6-(1,3-benzodioxol-5-yl)-7H-purine-2,6-diamine CAS Name: N6-(1,3-benzodioxol-5-yl)-7H-purine-2,6-diamine IUPAC Name: 6-N-(1,3-benzodioxol-5-yl)-7H-purine-2,6-diamine Traditional Name: (2-amino-7H-purin-6-yl)-(1,3-benzodioxol-5-yl)amine Formula: C12H10N6O2 MolecularWeight: 270.2468

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3NC=N4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3NC=N4)N

InChI

InChI=1S/C12H10N6O2/c13-12-17-10-9(14-4-15-10)11(18-12)16-6-1-2-7-8(3-6)20-5-19-7/h1-4H,5H2,(H4,13,14,15,16,17,18)