2-({4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid

SpectraBase Compound ID	BzmD6RdqLHT
InChI	InChI=1S/C21H17ClN2O4S2/c22-15-8-3-1-6-13(15)12-17-19(26)24(21(29)30-17)11-5-10-18(25)23-16-9-4-2-7-14(16)20(27)28/h1-4,6-9,12H,5,10-11H2,(H,23,25)(H,27,28)/b17-12-
InChIKey	CIFOLZZFMMWRKW-ATVHPVEESA-N Google Search
Mol Weight	460.95 g/mol
Molecular Formula	C21H17ClN2O4S2
Exact Mass	460.031827 g/mol

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SpectraBase Spectrum ID	J1xxk6xgLlP
Name	2-({4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
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/C21H17ClN2O4S2/c22-15-8-3-1-6-13(15)12-17-19(26)24(21(29)30-17)11-5-10-18(25)23-16-9-4-2-7-14(16)20(27)28/h1-4,6-9,12H,5,10-11H2,(H,23,25)(H,27,28)/b17-12-
InChIKey	CIFOLZZFMMWRKW-ATVHPVEESA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9726
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: 128433; Labnumber: EX00110776; VK_ID: VK-009730
Synonyms	2-({4-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
Temperature	318 °C