2-[4-(3-Ethyl-4-Oxo-2-Thioxothiazolidin-5-Ylidene)-2-Butenylidene]-3(2H)-Benzothiazole-1-Propanesulfonic Acid
[CAS# 64285-53-6]

Identification

• Name: 2-[4-(3-Ethyl-4-Oxo-2-Thioxothiazolidin-5-Ylidene)-2-Butenylidene]-3(2H)-Benzothiazole-1-Propanesulfonic Acid
• Synonyms: 3-[(2Z)-2-[(E,4E)-4-(3-Ethyl-4-Oxo-2-Thioxo-Thiazolidin-5-Ylidene)But-2-Enylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonic Acid; 3-[(2Z)-2-[(E,4E)-4-(3-Ethyl-4-Oxo-2-Thioxo-5-Thiazolidinylidene)But-2-Enylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonic Acid; 3-[(2Z)-2-[(E,4E)-4-(3-Ethyl-4-Keto-2-Thioxo-Thiazolidin-5-Ylidene)But-2-Enylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonic Acid
• Molecular Formula: C₁₉H₂₀N₂O₄S₄
• Molecular Weight: 468.62
• CAS Registry Number: 64285-53-6
• SMILES: C2=C1N(\C(SC1=CC=C2)=C\C=C\C=C/3SC(=S)N(C3=O)CC)CCC[S](=O)(=O)O
• InChI: 1S/C19H20N2O4S4/c1-2-20-18(22)16(28-19(20)26)10-5-6-11-17-21(12-7-13-29(23,24)25)14-8-3-4-9-15(14)27-17/h3-6,8-11H,2,7,12-13H2,1H3,(H,23,24,25)/b6-5+,16-10+,17-11-
• InChIKey: JLOOCJQAEWGRMY-PEYWQWAXSA-N

Properties

• Density: 1.543g/cm³ (Cal.)