Chem
J-GLOBAL ID：200907000695884877   Nikkaji number：J1.811.799A

N,N′-[[[(1S,2R)-1-Methyl-2-hydroxy-2-phenylethyl]imino]bis[(S)-2-isopropylethylene]]bis(trifluoromethanesulfonamide)

N,N′-[[[(1S,2R)-1-メチル-2-ヒドロキシ-2-フェニルエチル]イミノ]ビス[(S)-2-イソプロピルエチレン]]ビス(トリフルオロメタンスルホンアミド)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H33F6N3O5S2
Molecular formula furigana： C21-H33-F6-N3-O5-S2
Molecular weight： 585.620
InChI： InChI=1S/C21H33F6N3O5S2/c1-13(2)17(28-36(32,33)20(22,23)24)11-30(15(5)19(31)16-9-7-6-8-10-16)12-18(14(3)4)29-37(34,35)21(25,26)27/h6-10,13-15,17-19,28-29,31H,11-12H2,1-5H3/t15-,17+,18+,19-/m0/s1
InChI key： UFVVYWMPXVSTIY-AITUJVMLSA-N
SMILES： CC(C)[C@@H](CN(C[C@@H](NS(=O)(=O)C(F)(F)F)C(C)C)[C@@H](C)[C@H](O)c1ccccc1)NS(=O)(=O)C(F)(F)F
Systematic name  (3)：
  • N,N′-[[[(1S,2R)-1-メチル-2-ヒドロキシ-2-フェニルエチル]イミノ]ビス[(S)-2-イソプロピルエチレン]]ビス(トリフルオロメタンスルホンアミド)
  • 1,1,1-トリフルオロ-N-[(2S)-1-{[(1R,2S)-1-ヒドロキシ-1-フェニルプロパン-2-イル][(2S)-3-メチル-2-(トリフルオロメタンスルホンアミド)ブチル]アミノ}-3-メチルブタン-2-イル]メタンスルホンアミド
  • 1,1,1-trifluoro-N-[(2S)-1-{[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl][(2S)-3-methyl-2-(trifluoromethanesulfonamido)butyl]amino}-3-methylbutan-2-yl]methanesulfonamide
Other name (1)：
  • N,N′-[[[(1S,2R)-1-Methyl-2-hydroxy-2-phenylethyl]imino]bis[(S)-2-isopropylethylene]]bis(trifluoromethanesulfonamide)
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