3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate

Systemtic Name: 3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate Openeye Name: 3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate CAS Name: 3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate IUPAC Name: 3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate Traditional Name: 3-(3-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidine-4-thiolate Formula: C11H6N5O2S- MolecularWeight: 272.26264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C3C(=NN2)N=CN=C3[S-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C3C(=NN2)N=CN=C3[S-]

InChI

InChI=1S/C11H7N5O2S/c17-16(18)7-3-1-2-6(4-7)9-8-10(15-14-9)12-5-13-11(8)19/h1-5H,(H2,12,13,14,15,19)/p-1