5-Chloro-2-[2-[(5-Chloro-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-3-(3-Sulphonatobutyl)Benzothiazolium inner salt
[CAS# 18426-55-6]

Identification

• Name: 5-Chloro-2-[2-[(5-Chloro-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-3-(3-Sulphonatobutyl)Benzothiazolium inner salt
• Synonyms: 5-Chloro-2-(2-((5-Chloro-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl)But-1-Enyl)-3-(3-Sulphonatobutyl)Benzothiazolium; Benzothiazolium, 5-Chloro-2-(2-((5-Chloro-3-Ethyl-2(3H)-Benzothiazolylidene)Methyl)-1-Butenyl)-3-(3-Sulfobutyl)-, Inner Salt
• Molecular Formula: C₂₅H₂₆Cl₂N₂O₃S₃
• Molecular Weight: 569.58
• CAS Registry Number: 18426-55-6
• EINECS: 242-302-7
• SMILES: C1=C(Cl)C=CC2=C1[N+](=C(S2)C=C(C=C4SC3=CC=C(Cl)C=C3N4CC)CC)CCC([S]([O-])(=O)=O)C
• InChI: 1S/C25H26Cl2N2O3S3/c1-4-17(12-24-28(5-2)20-14-18(26)6-8-22(20)33-24)13-25-29(11-10-16(3)35(30,31)32)21-15-19(27)7-9-23(21)34-25/h6-9,12-16H,4-5,10-11H2,1-3H3
• InChIKey: JUASOEGJZZHZCQ-UHFFFAOYSA-N