sodium 4-(2-sulfanylidene-1H-imidazol-3-yl)benzoate

Systemtic Name: sodium 4-(2-sulfanylidene-1H-imidazol-3-yl)benzoate Openeye Name: sodium 4-(2-thioxo-1H-imidazol-3-yl)benzoate CAS Name: sodium 4-(2-sulfanylidene-1H-imidazol-3-yl)benzoate IUPAC Name: sodium 4-(2-sulfanylidene-1H-imidazol-3-yl)benzoate Traditional Name: sodium 4-(2-thioxo-4-imidazolin-1-yl)benzoate Formula: C10H7N2NaO2S MolecularWeight: 242.22955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])N2C=CNC2=S.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])N2C=CNC2=S.[Na+]

InChI

InChI=1S/C10H8N2O2S.Na/c13-9(14)7-1-3-8(4-2-7)12-6-5-11-10(12)15;/h1-6H,(H,11,15)(H,13,14);/q;+1/p-1