9-(3-aminophenyl)sulfonylpurine-6-thiolate

Systemtic Name: 9-(3-aminophenyl)sulfonylpurine-6-thiolate Openeye Name: 9-(3-aminophenyl)sulfonylpurine-6-thiolate CAS Name: 9-(3-aminophenyl)sulfonyl-6-purinethiolate IUPAC Name: 9-(3-aminophenyl)sulfonylpurine-6-thiolate Traditional Name: 9-(3-aminophenyl)sulfonylpurine-6-thiolate Formula: C11H8N5O2S2- MolecularWeight: 306.34352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N2C=NC3=C2N=CN=C3[S-])N

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N2C=NC3=C2N=CN=C3[S-])N

InChI

InChI=1S/C11H9N5O2S2/c12-7-2-1-3-8(4-7)20(17,18)16-6-15-9-10(16)13-5-14-11(9)19/h1-6H,12H2,(H,13,14,19)/p-1