3-Ethyl-2-[[3-[3-[3-[(3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]-5,5-Dimethylcyclohex-2-En-1-Ylidene]Prop-1-Enyl]-5,5-Dimethylcyclohex-2-En-1-Ylidene]Methyl]Benzothiazolium Perchlorate
[CAS# 65767-27-3]

Identification

• Name: 3-Ethyl-2-[[3-[3-[3-[(3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]-5,5-Dimethylcyclohex-2-En-1-Ylidene]Prop-1-Enyl]-5,5-Dimethylcyclohex-2-En-1-Ylidene]Methyl]Benzothiazolium Perchlorate
• Synonyms: (2Z)-3-Ethyl-2-[[(3Z)-3-[(E)-3-[(3Z)-3-[(3-Ethyl-2H-1,3-Benzothiazol-1-Ium-2-Yl)Methylene]-5,5-Dimethyl-1-Cyclohexenyl]Prop-2-Enylidene]-5,5-Dimethyl-1-Cyclohexenyl]Methylene]-1,3-Benzothiazole Perchlorate; 3-Ethyl-2-((3-(3-(3-((3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl)-5,5-Dimethylcyclohex-2-En-1-Ylidene)Prop-1-Enyl)-5,5-Dimethylcyclohex-2-En-1-Ylidene)Methyl)Benzothiazolium Perchlorate
• Molecular Formula: C₃₉H₄₇ClN₂O₄S₂
• Molecular Weight: 707.38
• CAS Registry Number: 65767-27-3
• EINECS: 265-913-0
• SMILES: [SH+]1C(N(C2=CC=CC=C12)CC)/C=C3/CC(CC(=C3)/C=C/C=C4/CC(CC(=C4)\C=C\6SC5=CC=CC=C5N6CC)(C)C)(C)C.O=[Cl]([O-])(=O)=O
• InChI: 1S/C39H46N2S2.ClHO4/c1-7-40-32-16-9-11-18-34(32)42-36(40)22-30-20-28(24-38(3,4)26-30)14-13-15-29-21-31(27-39(5,6)25-29)23-37-41(8-2)33-17-10-12-19-35(33)43-37;2-1(3,4)5/h9-23,36H,7-8,24-27H2,1-6H3;(H,2,3,4,5)/b14-13+,29-15+,30-22+,37-23-
• InChIKey: LVZYVMMHEJOPKW-LMBGMYKYSA-N