sodium 3-chloranyl-4-oxidanylidene-1-(4-sulfamoylphenyl)-2-sulfanyl-azetidine-2-thiolate

Systemtic Name: sodium 3-chloranyl-4-oxidanylidene-1-(4-sulfamoylphenyl)-2-sulfanyl-azetidine-2-thiolate Openeye Name: sodium 3-chloro-4-oxo-1-(4-sulfamoylphenyl)-2-sulfanyl-azetidine-2-thiolate CAS Name: sodium 3-chloro-2-mercapto-4-oxo-1-(4-sulfamoylphenyl)-2-azetidinethiolate IUPAC Name: sodium 3-chloro-4-oxo-1-(4-sulfamoylphenyl)-2-sulfanylazetidine-2-thiolate Traditional Name: sodium 3-chloro-4-keto-2-mercapto-1-(4-sulfamoylphenyl)azetidine-2-thiolate Formula: C9H8ClN2NaO3S3 MolecularWeight: 346.80919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(C2(S)[S-])Cl)S(=O)(=O)N.[Na+]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C(C2(S)[S-])Cl)S(=O)(=O)N.[Na+]

InChI

InChI=1S/C9H9ClN2O3S3.Na/c10-7-8(13)12(9(7,16)17)5-1-3-6(4-2-5)18(11,14)15;/h1-4,7,16-17H,(H2,11,14,15);/q;+1/p-1