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

Systemtic Name: 4-[(E)-[4-oxidanylidene-3-(4-oxidanyl-4-oxidanylidene-butyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[3-(4-hydroxy-4-oxo-butyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(E)-[3-(4-hydroxy-4-oxobutyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[3-(4-hydroxy-4-oxobutyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[3-(4-hydroxy-4-keto-butyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C15H13NO5S2 MolecularWeight: 351.39742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)CCCC(=O)O)C(=O)O

InChI

InChI=1S/C15H13NO5S2/c17-12(18)2-1-7-16-13(19)11(23-15(16)22)8-9-3-5-10(6-4-9)14(20)21/h3-6,8H,1-2,7H2,(H,17,18)(H,20,21)/b11-8+