3-Ethyl-2-[2-[[3-(2-Hydroxyethyl)-6-Methoxy-5-Methyl-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-6-Methoxy-5-Methylbenzothiazolium Iodide
[CAS# 63815-94-1]

Identification

• Name: 3-Ethyl-2-[2-[[3-(2-Hydroxyethyl)-6-Methoxy-5-Methyl-3H-Benzothiazol-2-Ylidene]Methyl]But-1-Enyl]-6-Methoxy-5-Methylbenzothiazolium Iodide
• Synonyms: Benzothiazolium, 3-Ethyl-2-(2-((3-(2-Hydroxyethyl)-6-Methoxy-5-Methyl-2(3H)-Benzothiazolylidene)Methyl)-1-Butenyl)-6-Methoxy-5-Methyl-, Iodide; 3-Ethyl-2-(2-((3-(2-Hydroxyethyl)-6-Methoxy-5-Methyl-3H-Benzothiazol-2-Ylidene)Methyl)But-1-Enyl)-6-Methoxy-5-Methylbenzothiazolium Iodide
• Molecular Formula: C₂₇H₃₃IN₂O₃S₂
• Molecular Weight: 624.59
• CAS Registry Number: 63815-94-1
• EINECS: 264-482-6
• SMILES: C1=C(OC)C(=CC2=C1SC(=[N+]2CC)C=C(C=C3SC4=C(N3CCO)C=C(C(=C4)OC)C)CC)C.[I-]
• InChI: 1S/C27H33N2O3S2.HI/c1-7-19(13-26-28(8-2)20-11-17(3)22(31-5)15-24(20)33-26)14-27-29(9-10-30)21-12-18(4)23(32-6)16-25(21)34-27;/h11-16,30H,7-10H2,1-6H3;1H/q+1;/p-1
• InChIKey: FQITWMPLHQNZBR-UHFFFAOYSA-M