Chem
J-GLOBAL ID：200907031630849180
Nikkaji number：J2.706.364K
(2S)-1-Tosyl-2α-[(S)-1-(2,4-dimethoxybenzoyl)ethyl]pyrrolidine
(2S)-1-トシル-2α-[(S)-1-(2,4-ジメトキシベンゾイル)エチル]ピロリジン
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
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
Molecular formula： C22H27NO5S
Molecular formula furigana： C22-H27-N-O5-S
Molecular weight： 417.520
InChI：
InChI=1S/C22H27NO5S/c1-15-7-10-18(11-8-15)29(25,26)23-13-5-6-20(23)16(2)22(24)19-12-9-17(27-3)14-21(19)28-4/h7-12,14,16,20H,5-6,13H2,1-4H3/t16-,20-/m0/s1
InChI key：
LTCUQBAUIPAEQZ-JXFKEZNVSA-N
SMILES：
COc1ccc(C(=O)[C@@H](C)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c(OC)c1
Systematic name (3)：
- (2S)-1-トシル-2α-[(S)-1-(2,4-ジメトキシベンゾイル)エチル]ピロリジン
- (2S)-1-(2,4-ジメトキシフェニル)-2-[(2S)-1-(4-メチルベンゼンスルホニル)ピロリジン-2-イル]プロパン-1-オン
- (2S)-1-(2,4-dimethoxyphenyl)-2-[(2S)-1-(4-methylbenzenesulfonyl)pyrrolidin-2-yl]propan-1-one
- (2S)-1-Tosyl-2α-[(S)-1-(2,4-dimethoxybenzoyl)ethyl]pyrrolidine
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