Chem
J-GLOBAL ID:200907099508340709   Nikkaji number:J2.580.661A

1,4-Ditosyl-5β-isopropyl-2,3,3aα,4,5,6-hexahydro-1H-pyrrolo[3,2-b]pyridine

1,4-ジトシル-5β-イソプロピル-2,3,3aα,4,5,6-ヘキサヒドロ-1H-ピロロ[3,2-b]ピリジン
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: C24H30N2O4S2
Molecular formula furigana: C24-H30-N2-O4-S2
Molecular weight: 474.630
InChI: InChI=1S/C24H30N2O4S2/c1-17(2)22-13-14-23-24(26(22)32(29,30)21-11-7-19(4)8-12-21)15-16-25(23)31(27,28)20-9-5-18(3)6-10-20/h5-12,14,17,22,24H,13,15-16H2,1-4H3/t22-,24-/m1/s1
InChI key: PPDIITHHVJTKGH-ISKFKSNPSA-N
SMILES: CC(C)[C@H]1CC=C2[C@@H](CCN2S(=O)(=O)c2ccc(C)cc2)N1S(=O)(=O)c1ccc(C)cc1
Systematic name  (3):
  • 1,4-ジトシル-5β-イソプロピル-2,3,3aα,4,5,6-ヘキサヒドロ-1H-ピロロ[3,2-b]ピリジン
  • (3aR,5R)-1,4-ビス(4-メチルベンゼンスルホニル)-5-(プロパン-2-イル)-1H,2H,3H,3aH,4H,5H,6H-ピロロ[3,2-b]ピリジン
  • (3aR,5R)-1,4-bis(4-methylbenzenesulfonyl)-5-(propan-2-yl)-1H,2H,3H,3aH,4H,5H,6H-pyrrolo[3,2-b]pyridine
Other name (1):
  • 1,4-Ditosyl-5β-isopropyl-2,3,3aα,4,5,6-hexahydro-1H-pyrrolo[3,2-b]pyridine
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