2-[4-(Acetylanilino)-1,3-Butadienyl]-3-(3-Sulphonatobutyl)Naphtho[2,3-d]Thiazolium
[CAS# 63148-84-5]

Identification

• Name: 2-[4-(Acetylanilino)-1,3-Butadienyl]-3-(3-Sulphonatobutyl)Naphtho[2,3-d]Thiazolium
• Synonyms: 4-[2-[(3E)-4-(Acetyl-Phenyl-Amino)Buta-1,3-Dienyl]Benzo[F][1,3]Benzothiazol-3-Ium-3-Yl]Butane-2-Sulfonate; 4-[2-[(3E)-4-(Acetyl-Phenylamino)Buta-1,3-Dienyl]-3-Benzo[F][1,3]Benzothiazol-3-Iumyl]Butane-2-Sulfonate; 4-[2-[(3E)-4-(Ethanoyl-Phenyl-Amino)Buta-1,3-Dienyl]Benzo[F][1,3]Benzothiazol-3-Ium-3-Yl]Butane-2-Sulfonate
• Molecular Formula: C₂₇H₂₆N₂O₄S₂
• Molecular Weight: 506.63
• CAS Registry Number: 63148-84-5
• EINECS: 263-936-0
• SMILES: C2=C1[N+](=C(SC1=CC3=CC=CC=C23)C=CC=CN(C4=CC=CC=C4)C(=O)C)CCC([S]([O-])(=O)=O)C
• InChI: 1S/C27H26N2O4S2/c1-20(35(31,32)33)15-17-29-25-18-22-10-6-7-11-23(22)19-26(25)34-27(29)14-8-9-16-28(21(2)30)24-12-4-3-5-13-24/h3-14,16,18-20H,15,17H2,1-2H3
• InChIKey: YHHPTGQMZQAZEW-UHFFFAOYSA-N