2-azanyl-8-[[4-[2-(2-azanyl-6-oxidanylidene-3,5-dihydropurin-8-yl)hydrazinyl]phenyl]diazenyl]purin-6-one

Systemtic Name: 2-azanyl-8-[[4-[2-(2-azanyl-6-oxidanylidene-3,5-dihydropurin-8-yl)hydrazinyl]phenyl]diazenyl]purin-6-one Openeye Name: 2-amino-8-[4-[2-(2-amino-6-oxo-3,5-dihydropurin-8-yl)hydrazino]phenyl]azo-purin-6-one CAS Name: 2-amino-8-[4-[(2-amino-6-oxo-3,5-dihydropurin-8-yl)hydrazo]phenyl]azo-6-purinone IUPAC Name: 2-amino-8-[[4-[2-(2-amino-6-oxo-3,5-dihydropurin-8-yl)hydrazinyl]phenyl]diazenyl]purin-6-one Traditional Name: 2-amino-8-[4-[N'-(2-amino-6-keto-3,5-dihydropurin-8-yl)hydrazino]phenyl]azo-purin-6-one Formula: C16H12N14O2 MolecularWeight: 432.35908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NNC2=NC3C(=N2)NC(=NC3=O)N)N=NC4=NC5=NC(=NC(=O)C5=N4)N

Isomeric SMILES

C1=CC(=CC=C1NNC2=NC3C(=N2)NC(=NC3=O)N)N=NC4=NC5=NC(=NC(=O)C5=N4)N

InChI

InChI=1S/C16H12N14O2/c17-13-21-9-7(11(31)25-13)19-15(23-9)29-27-5-1-2-6(4-3-5)28-30-16-20-8-10(24-16)22-14(18)26-12(8)32/h1-4,7,27H,(H2,18,26,32)(H4,17,19,21,23,25,29,31)