2-azanyl-8-(2-azanylpurin-9-yl)-7-[2,6-bis(azanyl)purin-9-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-8-(2-azanylpurin-9-yl)-7-[2,6-bis(azanyl)purin-9-yl]-3H-purin-6-one Openeye Name: 2-amino-8-(2-aminopurin-9-yl)-7-(2,6-diaminopurin-9-yl)-3H-purin-6-one CAS Name: 2-amino-8-(2-amino-9-purinyl)-7-(2,6-diamino-9-purinyl)-3H-purin-6-one IUPAC Name: 2-amino-8-(2-aminopurin-9-yl)-7-(2,6-diaminopurin-9-yl)-3H-purin-6-one Traditional Name: 2-amino-8-(2-aminopurin-9-yl)-7-(2,6-diaminopurin-9-yl)-3H-purin-6-one Formula: C15H12N16O MolecularWeight: 432.36238

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=N1)N)N(C=N2)C3=NC4=C(N3N5C=NC6=C5N=C(N=C6N)N)C(=O)N=C(N4)N

Isomeric SMILES

C1=C2C(=NC(=N1)N)N(C=N2)C3=NC4=C(N3N5C=NC6=C5N=C(N=C6N)N)C(=O)N=C(N4)N

InChI

InChI=1S/C15H12N16O/c16-7-5-10(27-13(18)23-7)30(3-22-5)31-6-8(24-14(19)28-11(6)32)25-15(31)29-2-21-4-1-20-12(17)26-9(4)29/h1-3H,(H2,17,20,26)(H4,16,18,23,27)(H3,19,24,28,32)