1-(2-methoxyphenyl)-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-olate

Systemtic Name: 1-(2-methoxyphenyl)-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-olate Openeye Name: 1-(2-methoxyphenyl)-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-4-olate CAS Name: 1-(2-methoxyphenyl)-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-olate IUPAC Name: 1-(2-methoxyphenyl)-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-4-olate Traditional Name: 1-(2-methoxyphenyl)-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-4-olate Formula: C12H9N4O2S- MolecularWeight: 273.29046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=S)N=C(C3=CN2)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=S)N=C(C3=CN2)[O-]

InChI

InChI=1S/C12H10N4O2S/c1-18-9-5-3-2-4-8(9)16-10-7(6-13-16)11(17)15-12(19)14-10/h2-6,13H,1H3,(H,15,17,19)/p-1