3-isothiazolidinone, 2-[3-[(4-acetyl-1-piperazinyl)sulfonyl]-4-methoxyphenyl]-4-methyl-, 1,1-dioxide

SpectraBase Compound ID	IADELiyipZq
InChI	InChI=1S/C17H23N3O7S2/c1-12-11-28(23,24)20(17(12)22)14-4-5-15(27-3)16(10-14)29(25,26)19-8-6-18(7-9-19)13(2)21/h4-5,10,12H,6-9,11H2,1-3H3
InChIKey	ABOJZEBWTOJTLX-UHFFFAOYSA-N Google Search
Mol Weight	445.51 g/mol
Molecular Formula	C17H23N3O7S2
Exact Mass	445.097742 g/mol

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SpectraBase Spectrum ID	L3DYX4bl5rH
Name	3-isothiazolidinone, 2-[3-[(4-acetyl-1-piperazinyl)sulfonyl]-4-methoxyphenyl]-4-methyl-, 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/C17H23N3O7S2/c1-12-11-28(23,24)20(17(12)22)14-4-5-15(27-3)16(10-14)29(25,26)19-8-6-18(7-9-19)13(2)21/h4-5,10,12H,6-9,11H2,1-3H3
InChIKey	ABOJZEBWTOJTLX-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_9415
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: F35345; Labnumber: CHEKAN-00481