benzoic acid, 2-[[[4-(4-methyl-2-quinolinyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester

SpectraBase Compound ID	F1XoYB9DF5t
InChI	InChI=1S/C23H24N4O2S/c1-16-15-21(24-19-9-5-3-7-17(16)19)26-11-13-27(14-12-26)23(30)25-20-10-6-4-8-18(20)22(28)29-2/h3-10,15H,11-14H2,1-2H3,(H,25,30)
InChIKey	QCFASDLWVXJYLR-UHFFFAOYSA-N Google Search
Mol Weight	420.53 g/mol
Molecular Formula	C23H24N4O2S
Exact Mass	420.161997 g/mol

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SpectraBase Spectrum ID	Ddemukefdyo
Name	benzoic acid, 2-[[[4-(4-methyl-2-quinolinyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
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/C23H24N4O2S/c1-16-15-21(24-19-9-5-3-7-17(16)19)26-11-13-27(14-12-26)23(30)25-20-10-6-4-8-18(20)22(28)29-2/h3-10,15H,11-14H2,1-2H3,(H,25,30)
InChIKey	QCFASDLWVXJYLR-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_11111
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: F41046; Labnumber: NNA-V-24225
Temperature	315 °C