Hydrogen-2-[2-Methyl-3-[3-(3-Sulphonatopropyl)-3H-Benzothiazol-2-Ylidene]Prop-1-Enyl]-3-(3-Sulphonatopropyl)Benzothiazolium
[CAS# 17701-26-7]

Identification

• Name: Hydrogen-2-[2-Methyl-3-[3-(3-Sulphonatopropyl)-3H-Benzothiazol-2-Ylidene]Prop-1-Enyl]-3-(3-Sulphonatopropyl)Benzothiazolium
• Synonyms: 3-[(2Z)-2-[(E)-2-Methyl-3-[3-(3-Sulfopropyl)-1,3-Benzothiazol-3-Ium-2-Yl]Prop-2-Enylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonate; Bas 00170601; Benzothiazolium, 2-(2-Methyl-3-(3-(3-Sulfopropyl)-2(3H)-Benzothiazolylidene)-1-Propenyl)-3-(3-Sulfopropyl)-, Inner Salt
• Molecular Formula: C₂₄H₂₆N₂O₆S₄
• Molecular Weight: 566.72
• CAS Registry Number: 17701-26-7
• EINECS: 241-709-7
• SMILES: C2=C1N(C(SC1=CC=C2)=CC(=CC3=[N+](C4=C(S3)C=CC=C4)CCC[S](=O)(=O)[O-])C)CCC[S](O)(=O)=O
• InChI: 1S/C24H26N2O6S4/c1-18(16-23-25(12-6-14-35(27,28)29)19-8-2-4-10-21(19)33-23)17-24-26(13-7-15-36(30,31)32)20-9-3-5-11-22(20)34-24/h2-5,8-11,16-17H,6-7,12-15H2,1H3,(H-,27,28,29,30,31,32)
• InChIKey: UWKASGMADAVFBW-UHFFFAOYSA-N