4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Openeye Name: 4-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid CAS Name: 4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]benzoic acid IUPAC Name: 4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Traditional Name: 4-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid Formula: C12H9NO3S2 MolecularWeight: 279.33476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=S

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC=C(C=C2)C(=O)O)/SC1=S

InChI

InChI=1S/C12H9NO3S2/c1-13-10(14)9(18-12(13)17)6-7-2-4-8(5-3-7)11(15)16/h2-6H,1H3,(H,15,16)/b9-6+