1,3,5-Tris[[5-[[[(Isopropylideneamino)Oxy]Carbonyl]Amino]-1,3,3-Trimethylcyclohexyl]Methyl]-1,3,5-Triazine-2,4,6(1H,3H,5H)-Trione
[CAS# 68426-00-6]

Identification

• Name: 1,3,5-Tris[[5-[[[(Isopropylideneamino)Oxy]Carbonyl]Amino]-1,3,3-Trimethylcyclohexyl]Methyl]-1,3,5-Triazine-2,4,6(1H,3H,5H)-Trione
• Synonyms: (Isopropylamino) N-[(1S,3S)-3-[[3,5-Bis[[(1S,5S)-5-[(Isopropylamino)Oxycarbonylamino]-1,3,3-Trimethyl-Cyclohexyl]Methyl]-1,3,5-Triazine-1,3,5-Triium-1-Yl]Methyl]-3,5,5-Trimethyl-Cyclohexyl]Carbamate; N-[(1S,3S)-3-[[3,5-Bis[[(1S,5S)-5-[[(Isopropylamino)Oxy-Oxomethyl]Amino]-1,3,3-Trimethylcyclohexyl]Methyl]-1,3,5-Triazine-1,3,5-Triium-1-Yl]Methyl]-3,5,5-Trimethylcyclohexyl]Carbamic Acid (Isopropylamino) Ester; N-[(1S,3S)-3-[[3,5-Bis[[(1S,5S)-5-[(Isopropylamino)Oxycarbonylamino]-1,3,3-Trimethyl-Cyclohexyl]Methyl]-S-Triazine-1,3,5-Triium-1-Yl]Methyl]-3,5,5-Trimethyl-Cyclohexyl]Carbamic Acid (Isopropylamino) Ester
• Molecular Formula: C₄₅H₈₄N₉O₆
• Molecular Weight: 847.22
• CAS Registry Number: 68426-00-6
• EINECS: 270-379-7
• SMILES: [C@@]4(C[N+]1=C[N+](=C[N+](=C1)C[C@@]2(CC(C[C@H](NC(ONC(C)C)=O)C2)(C)C)C)C[C@]3(CC(C[C@H](NC(ONC(C)C)=O)C3)(C)C)C)(CC(C[C@H](NC(ONC(C)C)=O)C4)(C)C)C
• InChI: 1S/C45H81N9O6/c1-31(2)49-58-37(55)46-34-16-40(7,8)22-43(13,19-34)25-52-28-53(26-44(14)20-35(17-41(9,10)23-44)47-38(56)59-50-32(3)4)30-54(29-52)27-45(15)21-36(18-42(11,12)24-45)48-39(57)60-51-33(5)6/h28-36,49-51H,16-27H2,1-15H3/p+3/t34-,35-,36-,43-,44+,45+/m0/s1
• InChIKey: FSSFHBBDEPGYAR-XKUKIHBTSA-Q