5-[(6-Ethoxy-1-Ethyl-(1H)-Quinolin-2-Ylidene)Ethylidene]-3-Ethyl-3-Methyl-4-Oxo-2-Thioxothiazolidinium Toluene-p-Sulphonate
[CAS# 68516-66-5]

Identification

• Name: 5-[(6-Ethoxy-1-Ethyl-(1H)-Quinolin-2-Ylidene)Ethylidene]-3-Ethyl-3-Methyl-4-Oxo-2-Thioxothiazolidinium Toluene-p-Sulphonate
• Synonyms: (5Z)-5-[(2E)-2-(6-Ethoxy-1-Ethyl-2-Quinolylidene)Ethylidene]-3-Ethyl-3-Methyl-2-Thioxo-Thiazolidin-3-Ium-4-One; 4-Methylbenzenesulfonate; (5Z)-5-[(2E)-2-(6-Ethoxy-1-Ethyl-2-Quinolylidene)Ethylidene]-3-Ethyl-3-Methyl-2-Thioxo-4-Thiazolidin-3-Iumone; 4-Methylbenzenesulfonate; (5Z)-5-[(2E)-2-(6-Ethoxy-1-Ethyl-Quinolin-2-Ylidene)Ethylidene]-3-Ethyl-3-Methyl-2-Sulfanylidene-1,3-Thiazolidin-3-Ium-4-One; 4-Methylbenzenesulfonate
• Molecular Formula: C₂₈H₃₂N₂O₅S₃
• Molecular Weight: 572.75
• CAS Registry Number: 68516-66-5
• EINECS: 271-170-3
• SMILES: C1=CC(=CC3=C1N(C(=C/C=C/2SC(=S)[N+](C2=O)(CC)C)/C=C3)CC)OCC.C4=C([S]([O-])(=O)=O)C=CC(=C4)C
• InChI: 1S/C21H25N2O2S2.C7H8O3S/c1-5-22-16(9-8-15-14-17(25-7-3)11-12-18(15)22)10-13-19-20(24)23(4,6-2)21(26)27-19;1-6-2-4-7(5-3-6)11(8,9)10/h8-14H,5-7H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/b16-10+,19-13-
• InChIKey: JTKUVXFPQBFUHL-FCHXBNMSSA-M