2-[3-(3-Ethyl-5-Methylbenzothiazol-2(3H)-Ylidene)-2-(2-Furanyl)-1-Propenyl]-1-(3-Sulfonatopropyl)Naphtho[1,2-d]Thiazol-1-Ium
[CAS# 68239-17-8]

Identification

• Name: 2-[3-(3-Ethyl-5-Methylbenzothiazol-2(3H)-Ylidene)-2-(2-Furanyl)-1-Propenyl]-1-(3-Sulfonatopropyl)Naphtho[1,2-d]Thiazol-1-Ium
• Synonyms: 3-[2-[(Z,3Z)-3-(3-Ethyl-5-Methyl-1,3-Benzothiazol-2-Ylidene)-2-(2-Furyl)Prop-1-Enyl]Benzo[E][1,3]Benzothiazol-1-Ium-1-Yl]Propane-1-Sulfonate; 3-[2-[(Z,3Z)-3-(3-Ethyl-5-Methyl-1,3-Benzothiazol-2-Ylidene)-2-(2-Furyl)Prop-1-Enyl]-1-Benzo[E][1,3]Benzothiazol-1-Iumyl]Propane-1-Sulfonate; 3-[2-[(Z,3Z)-3-(3-Ethyl-5-Methyl-1,3-Benzothiazol-2-Ylidene)-2-Furan-2-Yl-Prop-1-Enyl]Benzo[E][1,3]Benzothiazol-1-Ium-1-Yl]Propane-1-Sulfonate
• Molecular Formula: C₃₁H₂₈N₂O₄S₃
• Molecular Weight: 588.75
• CAS Registry Number: 68239-17-8
• SMILES: C2=CC=CC3=C1[N+](=C(SC1=CC=C23)C=C(C4=CC=CO4)C=C6N(C5=CC(=CC=C5S6)C)CC)CCC[S](=O)(=O)[O-]
• InChI: 1S/C31H28N2O4S3/c1-3-32-25-18-21(2)11-13-27(25)38-29(32)19-23(26-10-6-16-37-26)20-30-33(15-7-17-40(34,35)36)31-24-9-5-4-8-22(24)12-14-28(31)39-30/h4-6,8-14,16,18-20H,3,7,15,17H2,1-2H3
• InChIKey: UYLBZKFZSFHEDU-UHFFFAOYSA-N