4-[2-(2-azanyl-6-sulfanylidene-purin-8-yl)hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-[2-(2-azanyl-6-sulfanylidene-purin-8-yl)hydrazinyl]benzenesulfonic acid Openeye Name: 4-[2-(2-amino-6-thioxo-purin-8-yl)hydrazino]benzenesulfonic acid CAS Name: 4-[(2-amino-6-sulfanylidene-8-purinyl)hydrazo]benzenesulfonic acid IUPAC Name: 4-[2-(2-amino-6-sulfanylidenepurin-8-yl)hydrazinyl]benzenesulfonic acid Traditional Name: 4-[N'-(2-amino-6-thioxo-purin-8-yl)hydrazino]besylic acid Formula: C11H9N7O3S2 MolecularWeight: 351.36426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NNC2=NC3=NC(=NC(=S)C3=N2)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NNC2=NC3=NC(=NC(=S)C3=N2)N)S(=O)(=O)O

InChI

InChI=1S/C11H9N7O3S2/c12-10-14-8-7(9(22)16-10)13-11(15-8)18-17-5-1-3-6(4-2-5)23(19,20)21/h1-4,17H,(H,19,20,21)(H3,12,14,15,16,18,22)