3-phenyl-2-sulfanylidene-1H-imidazole-4,5-dicarboxylic acid

Systemtic Name: 3-phenyl-2-sulfanylidene-1H-imidazole-4,5-dicarboxylic acid Openeye Name: 3-phenyl-2-thioxo-1H-imidazole-4,5-dicarboxylic acid CAS Name: 3-phenyl-2-sulfanylidene-1H-imidazole-4,5-dicarboxylic acid IUPAC Name: 3-phenyl-2-sulfanylidene-1H-imidazole-4,5-dicarboxylic acid Traditional Name: 1-phenyl-2-thioxo-4-imidazoline-4,5-dicarboxylic acid Formula: C11H8N2O4S MolecularWeight: 264.25722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(NC2=S)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(NC2=S)C(=O)O)C(=O)O

InChI

InChI=1S/C11H8N2O4S/c14-9(15)7-8(10(16)17)13(11(18)12-7)6-4-2-1-3-5-6/h1-5H,(H,12,18)(H,14,15)(H,16,17)