6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-olate

Systemtic Name: 6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-olate Openeye Name: 6-(2-ethoxy-2-oxo-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-olate CAS Name: 6-[(2-ethoxy-2-oxoethyl)thio]-1H-pyrazolo[3,4-d]pyrimidin-4-olate IUPAC Name: 6-(2-ethoxy-2-oxoethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-olate Traditional Name: 6-[(2-ethoxy-2-keto-ethyl)thio]-1H-pyrazolo[3,4-d]pyrimidin-4-olate Formula: C9H9N4O3S- MolecularWeight: 253.25776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=NN2)C(=N1)[O-]

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=NN2)C(=N1)[O-]

InChI

InChI=1S/C9H10N4O3S/c1-2-16-6(14)4-17-9-11-7-5(3-10-13-7)8(15)12-9/h3H,2,4H2,1H3,(H2,10,11,12,13,15)/p-1