N-{[2-(4-chlorophenyl)-4-quinolinyl]carbonyl}-N'-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)thiourea

SpectraBase Compound ID	KC0vzmBC3cJ
InChI	InChI=1S/C26H19ClN4OS2/c27-16-11-9-15(10-12-16)22-13-19(17-5-1-3-7-21(17)29-22)24(32)30-26(33)31-25-20(14-28)18-6-2-4-8-23(18)34-25/h1,3,5,7,9-13H,2,4,6,8H2,(H2,30,31,32,33)
InChIKey	ZGAZAWZAWVXIIF-UHFFFAOYSA-N Google Search
Mol Weight	503.04 g/mol
Molecular Formula	C26H19ClN4OS2
Exact Mass	502.068881 g/mol

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SpectraBase Spectrum ID	EwLFYQ3dcKC
Name	N-{[2-(4-chlorophenyl)-4-quinolinyl]carbonyl}-N'-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)thiourea
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/C26H19ClN4OS2/c27-16-11-9-15(10-12-16)22-13-19(17-5-1-3-7-21(17)29-22)24(32)30-26(33)31-25-20(14-28)18-6-2-4-8-23(18)34-25/h1,3,5,7,9-13H,2,4,6,8H2,(H2,30,31,32,33)
InChIKey	ZGAZAWZAWVXIIF-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_9012
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: 1001979; UBI_ID: UBI-009015
Temperature	313 °C