3-Methyl-2-[2-[(3-Methyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]Benzothiazolium Bromide
[CAS# 69766-80-9]

Identification

• Name: 3-Methyl-2-[2-[(3-Methyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]Benzothiazolium Bromide
• Synonyms: 3-Methyl-2-(2-((3-Methyl-3H-Benzothiazol-2-Ylidene)Methyl)But-1-Enyl)Benzothiazolium Bromide; Benzothiazolium, 3-Methyl-2-(2-((3-Methyl-2(3H)-Benzothiazolylidene)Methyl)-1-Butenyl)-, Bromide
• Molecular Formula: C₂₁H₂₁BrN₂S₂
• Molecular Weight: 445.43
• CAS Registry Number: 69766-80-9
• EINECS: 274-107-8
• SMILES: C2=C1[N+](=C(SC1=CC=C2)C=C(\C=C/4SC3=CC=CC=C3N4C)CC)C.[Br-]
• InChI: 1S/C21H21N2S2.BrH/c1-4-15(13-20-22(2)16-9-5-7-11-18(16)24-20)14-21-23(3)17-10-6-8-12-19(17)25-21;/h5-14H,4H2,1-3H3;1H/q+1;/p-1
• InChIKey: YGIDDLBDMNEECL-UHFFFAOYSA-M