3-Allyl-2-[[4,5-Diphenyl-3-(4-Sulphonatobutyl)Thiazol-2(3H)-Ylidene]Methyl]-5-[(3-Ethylbenzothiazol-2(3H)-Ylidene)Ethylidene]-4-Oxothiazolium
[CAS# 93857-84-2]

Identification

• Name: 3-Allyl-2-[[4,5-Diphenyl-3-(4-Sulphonatobutyl)Thiazol-2(3H)-Ylidene]Methyl]-5-[(3-Ethylbenzothiazol-2(3H)-Ylidene)Ethylidene]-4-Oxothiazolium
• Synonyms: 4-[(2Z)-2-[[(5Z)-3-Allyl-5-[(2E)-2-(3-Ethyl-1,3-Benzothiazol-2-Ylidene)Ethylidene]-4-Oxo-Thiazol-3-Ium-2-Yl]Methylene]-4,5-Di(Phenyl)Thiazol-3-Yl]Butane-1-Sulfonate; 4-[(2Z)-2-[[(5Z)-3-Allyl-5-[(2E)-2-(3-Ethyl-1,3-Benzothiazol-2-Ylidene)Ethylidene]-4-Oxo-2
• Molecular Formula: C₃₇H₃₅N₃O₄S₄
• Molecular Weight: 713.94
• CAS Registry Number: 93857-84-2
• EINECS: 299-217-3
• SMILES: [S+]1=C([N](CCCC[S]([O-])(=O)=O)C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C=C4SC(/C(=O)N4CC=C)=C\C=C/6SC5=CC=CC=C5N6CC
• InChI: 1S/C37H35N3O4S4/c1-3-23-40-34(46-31(37(40)41)21-22-32-38(4-2)29-19-11-12-20-30(29)45-32)26-33-39(24-13-14-25-48(42,43)44)35(27-15-7-5-8-16-27)36(47-33)28-17-9-6-10-18-28/h3,5-12,15-22,26H,1,4,13-14,23-25H2,2H3/b31-21-,32-22+
• InChIKey: GWKKNZAGOAPRDB-MXEGIGMXSA-N