3,6-bis(azanyl)-5-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3,6-bis(azanyl)-5-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3,6-diamino-5-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3,6-diamino-5-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3,6-diamino-5-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3,6-diamino-5-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C12H11N7O2 MolecularWeight: 285.26144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNN2C(=O)C3=C(NN=C3N=C2N)N)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\NN2C(=O)C3=C(NN=C3N=C2N)N)/C(=O)C=C1

InChI

InChI=1S/C12H11N7O2/c13-9-8-10(18-17-9)16-12(14)19(11(8)21)15-5-6-3-1-2-4-7(6)20/h1-5,15H,(H5,13,14,16,17,18)/b6-5+