4-[4-(3-Ethyl-4-Oxo-2-Thioxo-5- Thiazolidinylidene)-2-Butenylidene]-1(4H)-Quinolinepropanesulfonic Acid Sodium Salt
[CAS# 68107-18-6]

Identification

• Name: 4-[4-(3-Ethyl-4-Oxo-2-Thioxo-5- Thiazolidinylidene)-2-Butenylidene]-1(4H)-Quinolinepropanesulfonic Acid Sodium Salt
• Synonyms: Sodium 3-[(4Z)-4-[(E,4Z)-4-(3-Ethyl-4-Oxo-2-Thioxo-Thiazolidin-5-Ylidene)But-2-Enylidene]-1-Quinolyl]Propane-1-Sulfonate; Sodium 3-[(4Z)-4-[(E,4Z)-4-(3-Ethyl-4-Oxo-2-Thioxo-5-Thiazolidinylidene)But-2-Enylidene]-1-Quinolyl]Propane-1-Sulfonate; Sodium 3-[(4Z)-4-[(E,4Z)-4-(3-Ethyl-4-Keto-2-Thioxo-Thiazolidin-5-Ylidene)But-2-Enylidene]-1-Quinolyl]Propane-1-Sulfonate
• Molecular Formula: C₂₁H₂₁N₂NaO₄S₃
• Molecular Weight: 484.58
• CAS Registry Number: 68107-18-6
• SMILES: C1=CC=CC2=C1\C(C=CN2CCC[S]([O-])(=O)=O)=C/C=C/C=C/3SC(=S)N(C3=O)CC.[Na+]
• InChI: 1S/C21H22N2O4S3.Na/c1-2-23-20(24)19(29-21(23)28)11-6-3-8-16-12-14-22(13-7-15-30(25,26)27)18-10-5-4-9-17(16)18;/h3-6,8-12,14H,2,7,13,15H2,1H3,(H,25,26,27);/q;+1/p-1/b6-3+,16-8-,19-11-
• InChIKey: FAXPCTRHXLEEBC-IVLCTAEISA-M