2-(5-methyl-2-thienyl)-4-{[4-(4-nitrophenyl)-1-piperazinyl]carbonyl}quinoline

SpectraBase Compound ID	8gmRk9Zrvl4
InChI	InChI=1S/C25H22N4O3S/c1-17-6-11-24(33-17)23-16-21(20-4-2-3-5-22(20)26-23)25(30)28-14-12-27(13-15-28)18-7-9-19(10-8-18)29(31)32/h2-11,16H,12-15H2,1H3
InChIKey	OFFKCLIBICCJKS-UHFFFAOYSA-N Google Search
Mol Weight	458.54 g/mol
Molecular Formula	C25H22N4O3S
Exact Mass	458.141262 g/mol

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SpectraBase Spectrum ID	LuCIRDjsI2T
Name	2-(5-methyl-2-thienyl)-4-{[4-(4-nitrophenyl)-1-piperazinyl]carbonyl}quinoline
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/C25H22N4O3S/c1-17-6-11-24(33-17)23-16-21(20-4-2-3-5-22(20)26-23)25(30)28-14-12-27(13-15-28)18-7-9-19(10-8-18)29(31)32/h2-11,16H,12-15H2,1H3
InChIKey	OFFKCLIBICCJKS-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_14563
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: UZI/9070929; Labnumber: NSB0069931; UZI_ID: UZI-014567
Temperature	318 °C