Chem
J-GLOBAL ID：200907092168945169   Nikkaji number：J2.706.359D

(2S)-1-Tosyl-2α-(β-oxo-2,4-dimethoxy-5-bromophenethyl)-5α-isopropylpyrrolidine

(2S)-1-トシル-2α-(β-オキソ-2,4-ジメトキシ-5-ブロモフェネチル)-5α-イソプロピルピロリジン
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： C24H30BrNO5S
Molecular formula furigana： C24-H30-BR-N-O5-S
Molecular weight： 524.470
InChI： InChI=1S/C24H30BrNO5S/c1-15(2)21-11-8-17(26(21)32(28,29)18-9-6-16(3)7-10-18)12-22(27)19-13-20(25)24(31-5)14-23(19)30-4/h6-7,9-10,13-15,17,21H,8,11-12H2,1-5H3/t17-,21+/m0/s1
InChI key： PQTJLMJAURZMKD-LAUBAEHRSA-N
SMILES： COc1cc(OC)c(cc1Br)C(=O)C[C@@H]1CC[C@H](C(C)C)N1S(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • (2S)-1-トシル-2α-(β-オキソ-2,4-ジメトキシ-5-ブロモフェネチル)-5α-イソプロピルピロリジン
  • 1-(5-ブロモ-2,4-ジメトキシフェニル)-2-[(2S,5R)-1-(4-メチルベンゼンスルホニル)-5-(プロパン-2-イル)ピロリジン-2-イル]エタン-1-オン
  • 1-(5-bromo-2,4-dimethoxyphenyl)-2-[(2S,5R)-1-(4-methylbenzenesulfonyl)-5-(propan-2-yl)pyrrolidin-2-yl]ethan-1-one
Other name (1)：
  • (2S)-1-Tosyl-2α-(β-oxo-2,4-dimethoxy-5-bromophenethyl)-5α-isopropylpyrrolidine
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