(5E)-1-acetyl-5-[(6-methyl-2-piperidin-1-ylquinolin-3-yl)methylidene]-2-sulfanylideneimidazolidin-4-one

SpectraBase Compound ID	GErCk2B9MDX
InChI	InChI=1S/C21H22N4O2S/c1-13-6-7-17-15(10-13)11-16(19(22-17)24-8-4-3-5-9-24)12-18-20(27)23-21(28)25(18)14(2)26/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,27,28)/b18-12+
InChIKey	IVIMMEWWTLDJHC-LDADJPATSA-N Google Search
Mol Weight	394.49 g/mol
Molecular Formula	C21H22N4O2S
Exact Mass	394.146347 g/mol

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SpectraBase Spectrum ID	855BW0A9NZV
Name	4-imidazolidinone, 1-acetyl-5-[[6-methyl-2-(1-piperidinyl)-3-quinolinyl]methylene]-2-thioxo-, (5E)-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	394.146347136 u
Formula	C21H22N4O2S
InChI	InChI=1S/C21H22N4O2S/c1-13-6-7-17-15(10-13)11-16(19(22-17)24-8-4-3-5-9-24)12-18-20(27)23-21(28)25(18)14(2)26/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,27,28)/b18-12+
InChIKey	IVIMMEWWTLDJHC-LDADJPATSA-N
Molecular Weight	394.493 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_18059
Solvent	DMSO-d6
Source	Vendor ID: NMR/11211900; Lab Info: LP; Lab Number: LP-3800152