4-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-2-sulfanylidene-benzimidazole-5-carboxylic acid

Systemtic Name: 4-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-2-sulfanylidene-benzimidazole-5-carboxylic acid Openeye Name: 4-[(4-chloro-3-sulfamoyl-benzoyl)amino]-2-thioxo-benzimidazole-5-carboxylic acid CAS Name: 4-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]amino]-2-sulfanylidene-5-benzimidazolecarboxylic acid IUPAC Name: 4-[(4-chloro-3-sulfamoylbenzoyl)amino]-2-sulfanylidenebenzimidazole-5-carboxylic acid Traditional Name: 4-[(4-chloro-3-sulfamoyl-benzoyl)amino]-2-thioxo-benzimidazole-5-carboxylic acid Formula: C15H9ClN4O5S2 MolecularWeight: 424.83876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=C(C=CC3=NC(=S)N=C32)C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=C(C=CC3=NC(=S)N=C32)C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C15H9ClN4O5S2/c16-8-3-1-6(5-10(8)27(17,24)25)13(21)19-11-7(14(22)23)2-4-9-12(11)20-15(26)18-9/h1-5H,(H,19,21)(H,22,23)(H2,17,24,25)