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(5E)-5-[4-[[(2S)-1-(2-pyridyl)pyrrolidin-2-yl]methoxy]benzylidene]thiazolidine-2,4-quinone
SpectraBase Compound ID 4woOpsvO1Da
InChI InChI=1S/C20H19N3O3S/c24-19-17(27-20(25)22-19)12-14-6-8-16(9-7-14)26-13-15-4-3-11-23(15)18-5-1-2-10-21-18/h1-2,5-10,12,15H,3-4,11,13H2,(H,22,24,25)/b17-12+/t15-/m0/s1
InChIKey GRLCJTHTWOJWJS-YSKWHIJTSA-N
Mol Weight 381.45 g/mol
Molecular Formula C20H19N3O3S
Exact Mass 381.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gFXe5kVVmf
Name (5E)-5-[4-[[(2S)-1-(2-pyridyl)pyrrolidin-2-yl]methoxy]benzylidene]thiazolidine-2,4-quinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19N3O3S
InChI InChI=1S/C20H19N3O3S/c24-19-17(27-20(25)22-19)12-14-6-8-16(9-7-14)26-13-15-4-3-11-23(15)18-5-1-2-10-21-18/h1-2,5-10,12,15H,3-4,11,13H2,(H,22,24,25)/b17-12+/t15-/m0/s1
InChIKey GRLCJTHTWOJWJS-YSKWHIJTSA-N
Molecular Weight 381.450 g/mol
SMILES N1C(\C(SC1=O)=C/c1ccc(OC[C@]2(N(c3ncccc3)CCC2)[H])cc1)=O
SPLASH splash10-03di-0900000000-b53dbc1f63a69234a3b4
Source of Spectrum F2-42-2576-5
Synonyms (5E)-5-[[4-[[(2S)-1-(2-pyridinyl)-2-pyrrolidinyl]methoxy]phenyl]methylidene]thiazolidine-2,4-dione (5E)-5-[[4-[[(2S)-1-(2-pyridyl)pyrrolidin-2-yl]methoxy]phenyl]methylene]thiazolidine-2,4-dione (5E)-5-[[4-[[(2S)-1-pyridin-2-ylpyrrolidin-2-yl]methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
Wiley ID 1600205