4-(2-sulfanylidene-1H-imidazol-3-yl)benzenesulfonic acid

Systemtic Name: 4-(2-sulfanylidene-1H-imidazol-3-yl)benzenesulfonic acid Openeye Name: 4-(2-thioxo-1H-imidazol-3-yl)benzenesulfonic acid CAS Name: 4-(2-sulfanylidene-1H-imidazol-3-yl)benzenesulfonic acid IUPAC Name: 4-(2-sulfanylidene-1H-imidazol-3-yl)benzenesulfonic acid Traditional Name: 4-(2-thioxo-4-imidazolin-1-yl)besylic acid Formula: C9H8N2O3S2 MolecularWeight: 256.30142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=CNC2=S)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N2C=CNC2=S)S(=O)(=O)O

InChI

InChI=1S/C9H8N2O3S2/c12-16(13,14)8-3-1-7(2-4-8)11-6-5-10-9(11)15/h1-6H,(H,10,15)(H,12,13,14)