butanoic acid, 2-[[[4-(1H-indol-3-ylcarbonyl)-1-piperazinyl]carbonyl]amino]-4-(methylthio)-, (2S)-

SpectraBase Compound ID	2EjzD8Dey7l
InChI	InChI=1S/C19H24N4O4S/c1-28-11-6-16(18(25)26)21-19(27)23-9-7-22(8-10-23)17(24)14-12-20-15-5-3-2-4-13(14)15/h2-5,12,16,20H,6-11H2,1H3,(H,21,27)(H,25,26)
InChIKey	TUKYOPWJVWAFPH-UHFFFAOYSA-N Google Search
Mol Weight	404.49 g/mol
Molecular Formula	C19H24N4O4S
Exact Mass	404.151826 g/mol

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SpectraBase Spectrum ID	LxI7dIr13Ni
Name	butanoic acid, 2-[[[4-(1H-indol-3-ylcarbonyl)-1-piperazinyl]carbonyl]amino]-4-(methylthio)-, (2S)-
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C19H24N4O4S/c1-28-11-6-16(18(25)26)21-19(27)23-9-7-22(8-10-23)17(24)14-12-20-15-5-3-2-4-13(14)15/h2-5,12,16,20H,6-11H2,1H3,(H,21,27)(H,25,26)
InChIKey	TUKYOPWJVWAFPH-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_4007
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: F19756; Labnumber: EXP16Exi004816