(4E)-4-[[2-[[(E)-[4,5-Dioxo-2-Sulfanylidene-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidin-3-Ylidene]-Phenylmethyl]Amino]Ethylamino]-Phenylmethylidene]-5-Sulfanylidene-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidine-2,3-Dione
[CAS# 107888-01-7]

Identification

• Name: (4E)-4-[[2-[[(E)-[4,5-Dioxo-2-Sulfanylidene-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidin-3-Ylidene]-Phenylmethyl]Amino]Ethylamino]-Phenylmethylidene]-5-Sulfanylidene-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidine-2,3-Dione
• Synonyms: (4E)-4-[[2-[[(E)-[4,5-Dioxo-2-Thioxo-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidin-3-Ylidene]-Phenyl-Methyl]Amino]Ethylamino]-Phenyl-Methylene]-5-Thioxo-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidine-2,3-Dione; (4E)-4-[[2-[[(E)-[4,5-Dioxo-2-Thioxo-1-[3-(Trifluoromethyl)Phenyl]-3-Pyrrolidinylidene]-Phenylmethyl]Amino]Ethylamino]-Phenylmethylene]-5-Thioxo-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidine-2,3-Dione; (4E)-4-[[2-[[(E)-[4,5-Diketo-2-Thioxo-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidin-3-Ylidene]-Phenyl-Methyl]Amino]Ethylamino]-Phenyl-Methylene]-5-Thioxo-1-[3-(Trifluoromethyl)Phenyl]Pyrrolidine-2,3-Quinone
• Molecular Formula: C₃₈H₂₄F₆N₄O₄S₂
• Molecular Weight: 778.74
• CAS Registry Number: 107888-01-7
• SMILES: C6=C(N5C(\C(=C(NCCNC(=C1/C(N(C(C1=O)=O)C2=CC=CC(=C2)C(F)(F)F)=S)/C3=CC=CC=C3)/C4=CC=CC=C4)C(C5=O)=O)=S)C=C(C=C6)C(F)(F)F
• InChI: 1S/C38H24F6N4O4S2/c39-37(40,41)23-13-7-15-25(19-23)47-33(51)31(49)27(35(47)53)29(21-9-3-1-4-10-21)45-17-18-46-30(22-11-5-2-6-12-22)28-32(50)34(52)48(36(28)54)26-16-8-14-24(20-26)38(42,43)44/h1-16,19-20,45-46H,17-18H2/b29-27+,30-28+
• InChIKey: PMTLIHHYKWETPN-QAVVBOBSSA-N

Properties

• Density: 1.569g/cm³ (Cal.)
• Boiling point: 792.952°C at 760 mmHg (Cal.)
• Flash point: 433.362°C (Cal.)