3-(3-Hydroxypropyl)-2-[3-[3-(3-Hydroxypropyl)-5-Methoxy-3H-Benzothiazol-2-Ylidene]-2-Methylprop-1-Enyl]-5-Methoxybenzothiazolium Iodide
[CAS# 63123-36-4]

Identification

• Name: 3-(3-Hydroxypropyl)-2-[3-[3-(3-Hydroxypropyl)-5-Methoxy-3H-Benzothiazol-2-Ylidene]-2-Methylprop-1-Enyl]-5-Methoxybenzothiazolium Iodide
• Synonyms: 3-[2-[3-[3-(3-Hydroxypropyl)-5-Methoxy-1,3-Benzothiazol-2-Ylidene]-2-Methyl-Prop-1-Enyl]-5-Methoxy-1,3-Benzothiazol-3-Ium-3-Yl]Propan-1-Ol Iodide; 3-(3-Hydroxypropyl)-2-(3-(3-(3-Hydroxypropyl)-5-Methoxy-3H-Benzothiazol-2-Ylidene)-2-Methylprop-1-Enyl)-5-Methoxybenzothiazolium Iodide; Benzothiazolium, 3-(3-Hydroxypropyl)-2-(3-(3-(3-Hydroxypropyl)-5-Methoxy-2(3H)-Benzothiazolylidene)-2-Methyl-1-Propenyl)-5-Methoxy-, Iodide
• Molecular Formula: C₂₆H₃₁IN₂O₄S₂
• Molecular Weight: 626.57
• CAS Registry Number: 63123-36-4
• EINECS: 263-880-7
• SMILES: C1=CC(=CC2=C1SC(=[N+]2CCCO)C=C(\C=C\3SC4=C(N3CCCO)C=C(C=C4)OC)C)OC.[I-]
• InChI: 1S/C26H31N2O4S2.HI/c1-18(14-25-27(10-4-12-29)21-16-19(31-2)6-8-23(21)33-25)15-26-28(11-5-13-30)22-17-20(32-3)7-9-24(22)34-26;/h6-9,14-17,29-30H,4-5,10-13H2,1-3H3;1H/q+1;/p-1
• InChIKey: FQPTWMOIDJRKIA-UHFFFAOYSA-M