(4E)-2-[2-(Dibenzylamino)-4-Phenyl-1,3-Thiazol-5-Yl]-4-[2-(Dibenzyliminio)-1,3-Thiazol-5(2H)-Ylidene]-3-Oxo-1-Cyclobuten-1-Olate
[CAS# 153119-17-6]

Identification

• Name: (4E)-2-[2-(Dibenzylamino)-4-Phenyl-1,3-Thiazol-5-Yl]-4-[2-(Dibenzyliminio)-1,3-Thiazol-5(2H)-Ylidene]-3-Oxo-1-Cyclobuten-1-Olate
• Synonyms: 1-(2-Dibenzylamino-4-phenyl-thiazol-5-yl)-3-(2,5-dihydro-2- dibenzylimmonium-4-phenyl-thiazol-5-ylidene)-2-oxo-cyclobuten-4-olate
• Molecular Formula: C₄₄H₃₄N₄O₂S₂
• Molecular Weight: 714.90
• CAS Registry Number: 153119-17-6
• SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC(=C(S3)C4=C(/C(=C\5/C=NC(=[N+](CC6=CC=CC=C6)CC7=CC=CC=C7)S5)/C4=O)[O-])C8=CC=CC=C8
• InChI: 1S/C44H34N4O2S2/c49-40-37(36-26-45-43(51-36)47(27-31-16-6-1-7-17-31)28-32-18-8-2-9-19-32)41(50)38(40)42-39(35-24-14-5-15-25-35)46-44(52-42)48(29-33-20-10-3-11-21-33)30-34-22-12-4-13-23-34/h1-26H,27-30H2
• InChIKey: UVULNDRUMYHGJZ-UHFFFAOYSA-N

Properties

• Refractive index: (Cal.)