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

Systemtic Name: 2-[(E)-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzenesulfonic acid Openeye Name: 2-[(E)-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzenesulfonic acid CAS Name: 2-[(E)-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]benzenesulfonic acid IUPAC Name: 2-[(E)-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzenesulfonic acid Traditional Name: 2-[(E)-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]besylic acid Formula: C12H11NO4S3 MolecularWeight: 329.41504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC=CC=C2S(=O)(=O)O)SC1=S

Isomeric SMILES

CCN1C(=O)/C(=C\C2=CC=CC=C2S(=O)(=O)O)/SC1=S

InChI

InChI=1S/C12H11NO4S3/c1-2-13-11(14)9(19-12(13)18)7-8-5-3-4-6-10(8)20(15,16)17/h3-7H,2H2,1H3,(H,15,16,17)/b9-7+