2-(2-oxidanylidene-2-sulfanyl-ethyl)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(2-oxidanylidene-2-sulfanyl-ethyl)-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-(2-oxo-2-sulfanyl-ethyl)-3H-benzimidazole-5-carboxylic acid CAS Name: 2-(2-mercapto-2-oxoethyl)-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-(2-oxo-2-sulfanylethyl)-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-(2-keto-2-mercapto-ethyl)-3H-benzimidazole-5-carboxylic acid Formula: C10H8N2O3S MolecularWeight: 236.24712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)NC(=N2)CC(=O)S

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)NC(=N2)CC(=O)S

InChI

InChI=1S/C10H8N2O3S/c13-9(16)4-8-11-6-2-1-5(10(14)15)3-7(6)12-8/h1-3H,4H2,(H,11,12)(H,13,16)(H,14,15)