Chem
J-GLOBAL ID：200907065637804841   Nikkaji number：J1.006.323J

Dimethyl[3-[[4-[(S)-2-hydroxy-3-butoxypropoxy]phenyl]amino]-3-oxopropyl]sulfonium

[2-({4-[(2S)-3-ブトキシ-2-ヒドロキシプロポキシ]フェニル}カルバモイル)エチル]ジメチルスルファニウム
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： C18H30NO4[S+]
Molecular formula furigana： C18-H30-N-O4-S
Molecular weight： 356.500
InChI： InChI=1S/C18H29NO4S/c1-4-5-11-22-13-16(20)14-23-17-8-6-15(7-9-17)19-18(21)10-12-24(2)3/h6-9,16,20H,4-5,10-14H2,1-3H3/p+1/t16-/m0/s1
InChI key： WXEQIIYRZHZJNN-INIZCTEOSA-O
SMILES： CCCCOC[C@H](O)COc1ccc(NC(=O)CC[S+](C)C)cc1
Systematic name  (3)：
  • ジメチル[3-[[4-[(S)-2-ヒドロキシ-3-ブトキシプロポキシ]フェニル]アミノ]-3-オキソプロピル]スルホニウム
  • [2-({4-[(2S)-3-ブトキシ-2-ヒドロキシプロポキシ]フェニル}カルバモイル)エチル]ジメチルスルファニウム
  • [2-({4-[(2S)-3-butoxy-2-hydroxypropoxy]phenyl}carbamoyl)ethyl]dimethylsulfanium
Other name (1)：
  • Dimethyl[3-[[4-[(S)-2-hydroxy-3-butoxypropoxy]phenyl]amino]-3-oxopropyl]sulfonium
Thsaurus map：
Thesaurus Map

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