4-[(Z)-[4-oxidanylidene-3-(2-oxidanylidene-2-propan-2-yloxy-ethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid

Systemtic Name: 4-[(Z)-[4-oxidanylidene-3-(2-oxidanylidene-2-propan-2-yloxy-ethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[3-(2-isopropoxy-2-oxo-ethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(Z)-[4-oxo-3-(2-oxo-2-propan-2-yloxyethyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[4-oxo-3-(2-oxo-2-propan-2-yloxyethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[3-(2-isopropoxy-2-keto-ethyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C16H15NO5S2 MolecularWeight: 365.424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5S2/c1-9(2)22-13(18)8-17-14(19)12(24-16(17)23)7-10-3-5-11(6-4-10)15(20)21/h3-7,9H,8H2,1-2H3,(H,20,21)/b12-7-