2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-imidazole-5-carboxylic acid

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-imidazole-5-carboxylic acid Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-1H-imidazole-5-carboxylic acid CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-1H-imidazole-5-carboxylic acid IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1H-imidazole-5-carboxylic acid Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-1H-imidazole-5-carboxylic acid Formula: C12H9ClN2O3S MolecularWeight: 296.72946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NC=C(N2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NC=C(N2)C(=O)O)Cl

InChI

InChI=1S/C12H9ClN2O3S/c13-8-3-1-7(2-4-8)10(16)6-19-12-14-5-9(15-12)11(17)18/h1-5H,6H2,(H,14,15)(H,17,18)