2-chloro-6-ethoxy-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate

SpectraBase Compound ID	FqaUiVCdwmI
InChI	InChI=1S/C18H14ClNO5S3/c1-2-24-14-9-11(10-15-17(21)20-18(26)27-15)8-13(19)16(14)25-28(22,23)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,20,21,26)/b15-10-
InChIKey	MRGUODAOXGQZSL-GDNBJRDFSA-N Google Search
Mol Weight	455.95 g/mol
Molecular Formula	C18H14ClNO5S3
Exact Mass	454.972264 g/mol

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SpectraBase Spectrum ID	J2tzIFyiigD
Name	2-chloro-6-ethoxy-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
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/C18H14ClNO5S3/c1-2-24-14-9-11(10-15-17(21)20-18(26)27-15)8-13(19)16(14)25-28(22,23)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,20,21,26)/b15-10-
InChIKey	MRGUODAOXGQZSL-GDNBJRDFSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_7632
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: 9686787; UBI_ID: UBI-007635
Synonyms	2-chloro-6-ethoxy-4-[(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
Temperature	308 °C