(8Z)-8-(5-azanyl-2-methyl-1H-pyrazol-3-ylidene)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: (8Z)-8-(5-azanyl-2-methyl-1H-pyrazol-3-ylidene)-1,3-dimethyl-purine-2,6-dione Openeye Name: (8Z)-8-(5-amino-2-methyl-1H-pyrazol-3-ylidene)-1,3-dimethyl-purine-2,6-dione CAS Name: (8Z)-8-(5-amino-2-methyl-1H-pyrazol-3-ylidene)-1,3-dimethylpurine-2,6-dione IUPAC Name: (8Z)-8-(5-amino-2-methyl-1H-pyrazol-3-ylidene)-1,3-dimethylpurine-2,6-dione Traditional Name: (8Z)-8-(5-amino-2-methyl-3-pyrazolin-3-ylidene)-1,3-dimethyl-xanthine Formula: C11H13N7O2 MolecularWeight: 275.26662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2N=C3C(=N2)N(C(=O)N(C3=O)C)C)C=C(N1)N

Isomeric SMILES

CN1/C(=C\2/N=C3C(=N2)N(C(=O)N(C3=O)C)C)/C=C(N1)N

InChI

InChI=1S/C11H13N7O2/c1-16-9-7(10(19)17(2)11(16)20)13-8(14-9)5-4-6(12)15-18(5)3/h4,15H,12H2,1-3H3/b8-5-