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

Systemtic Name: 4-[(Z)-[4-oxidanylidene-3-(4-oxidanylidene-4-propoxy-butyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[4-oxo-3-(4-oxo-4-propoxy-butyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(Z)-[4-oxo-3-(4-oxo-4-propoxybutyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[4-oxo-3-(4-oxo-4-propoxybutyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[4-keto-3-(4-keto-4-propoxy-butyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C18H19NO5S2 MolecularWeight: 393.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=S

Isomeric SMILES

CCCOC(=O)CCCN1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)O)/SC1=S

InChI

InChI=1S/C18H19NO5S2/c1-2-10-24-15(20)4-3-9-19-16(21)14(26-18(19)25)11-12-5-7-13(8-6-12)17(22)23/h5-8,11H,2-4,9-10H2,1H3,(H,22,23)/b14-11-