9-(4-nitrophenyl)sulfanylpurine-6-thiolate

Systemtic Name: 9-(4-nitrophenyl)sulfanylpurine-6-thiolate Openeye Name: 9-(4-nitrophenyl)sulfanylpurine-6-thiolate CAS Name: 9-[(4-nitrophenyl)thio]-6-purinethiolate IUPAC Name: 9-(4-nitrophenyl)sulfanylpurine-6-thiolate Traditional Name: 9-[(4-nitrophenyl)thio]purine-6-thiolate Formula: C11H6N5O2S2- MolecularWeight: 304.32764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SN2C=NC3=C2N=CN=C3[S-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SN2C=NC3=C2N=CN=C3[S-]

InChI

InChI=1S/C11H7N5O2S2/c17-16(18)7-1-3-8(4-2-7)20-15-6-14-9-10(15)12-5-13-11(9)19/h1-6H,(H,12,13,19)/p-1