3-isothiazolidinone, 2-[4-ethoxy-3-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]-, 1,1-dioxide

SpectraBase Compound ID	IgeQHaIhg3k
InChI	InChI=1S/C21H25N3O6S2/c1-2-30-19-9-8-18(24-21(25)10-15-31(24,26)27)16-20(19)32(28,29)23-13-11-22(12-14-23)17-6-4-3-5-7-17/h3-9,16H,2,10-15H2,1H3
InChIKey	YKOSAZGSAFURPH-UHFFFAOYSA-N Google Search
Mol Weight	479.57 g/mol
Molecular Formula	C21H25N3O6S2
Exact Mass	479.118478 g/mol

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SpectraBase Spectrum ID	5mELBP9Kwv0
Name	3-isothiazolidinone, 2-[4-ethoxy-3-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]-, 1,1-dioxide
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/C21H25N3O6S2/c1-2-30-19-9-8-18(24-21(25)10-15-31(24,26)27)16-20(19)32(28,29)23-13-11-22(12-14-23)17-6-4-3-5-7-17/h3-9,16H,2,10-15H2,1H3
InChIKey	YKOSAZGSAFURPH-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8948
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: F33855; Labnumber: CHEKAN-00793