2-[(E)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]benzoic acid

Systemtic Name: 2-[(E)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]benzoic acid Openeye Name: 2-[(E)-(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]benzoic acid CAS Name: 2-[(E)-(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]benzoic acid IUPAC Name: 2-[(E)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzoic acid Traditional Name: 2-[(E)-(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]benzoic acid Formula: C11H8N2O3S MolecularWeight: 248.25782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)NC(=S)N2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/2\C(=O)NC(=S)N2)C(=O)O

InChI

InChI=1S/C11H8N2O3S/c14-9-8(12-11(17)13-9)5-6-3-1-2-4-7(6)10(15)16/h1-5H,(H,15,16)(H2,12,13,14,17)/b8-5+