2-({3-Allyl-5-[2-(1-ethyl-4(1H)-quinolinylidene)ethylidene]-4-oxo-1,3-thiazolidin-2-ylidene}methyl)-3-ethyl-5,6-dimethyl-1,3-benzoxazol-3-ium ethyl sulfate
[CAS# 93857-83-1]

Identification

• Name: 2-({3-Allyl-5-[2-(1-ethyl-4(1H)-quinolinylidene)ethylidene]-4-oxo-1,3-thiazolidin-2-ylidene}methyl)-3-ethyl-5,6-dimethyl-1,3-benzoxazol-3-ium ethyl sulfate
• Synonyms: ethyl 2-[[3-allyl-5-[(1-ethyl-1H-quinolin-4-ylidene)ethylidene]-4-oxothiazolidin-2-ylidene]methyl]-3-ethyl-5,6-dimethylbenzoxazolium sulphate
• Molecular Formula: C₃₃H₃₇N₃O₆S₂
• Molecular Weight: 635.79
• CAS Registry Number: 93857-83-1
• EINECS: 299-216-8
• SMILES: [O-]S(=O)(=O)OCC.CCN5/C=C\C(=CC=C3SC(=Cc2oc1cc(C)c(C)cc1[n+]2CC)N(CC=C)C3=O)c4ccccc45
• InChI: 1S/C31H32N3O2S.C2H6O4S/c1-6-16-34-30(20-29-33(8-3)26-18-21(4)22(5)19-27(26)36-29)37-28(31(34)35)14-13-23-15-17-32(7-2)25-12-10-9-11-24(23)25;1-2-6-7(3,4)5/h6,9-15,17-20H,1,7-8,16H2,2-5H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
• InChIKey: QOOKWYZFPLVVRK-UHFFFAOYSA-M