6,8-bis(chloranyl)-9-[1-(1,3-dioxan-5-yl)-2-methyl-propyl]purin-2-amine

Systemtic Name: 6,8-bis(chloranyl)-9-[1-(1,3-dioxan-5-yl)-2-methyl-propyl]purin-2-amine Openeye Name: 6,8-dichloro-9-[1-(1,3-dioxan-5-yl)-2-methyl-propyl]purin-2-amine CAS Name: 6,8-dichloro-9-[1-(1,3-dioxan-5-yl)-2-methylpropyl]-2-purinamine IUPAC Name: 6,8-dichloro-9-[1-(1,3-dioxan-5-yl)-2-methylpropyl]purin-2-amine Traditional Name: [6,8-dichloro-9-[1-(1,3-dioxan-5-yl)-2-methyl-propyl]purin-2-yl]amine Formula: C13H17Cl2N5O2 MolecularWeight: 346.21238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1COCOC1)N2C3=C(C(=NC(=N3)N)Cl)N=C2Cl

Isomeric SMILES

CC(C)C(C1COCOC1)N2C3=C(C(=NC(=N3)N)Cl)N=C2Cl

InChI

InChI=1S/C13H17Cl2N5O2/c1-6(2)9(7-3-21-5-22-4-7)20-11-8(17-12(20)15)10(14)18-13(16)19-11/h6-7,9H,3-5H2,1-2H3,(H2,16,18,19)