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

SpectraBase Compound ID	4TvIPpiTCIX
InChI	InChI=1S/C17H23N3O6S2/c1-13(21)18-8-10-19(11-9-18)28(25,26)15-6-4-14(5-7-15)20-16(22)17(2,3)12-27(20,23)24/h4-7H,8-12H2,1-3H3
InChIKey	GKEQQIWBMMJCQL-UHFFFAOYSA-N Google Search
Mol Weight	429.51 g/mol
Molecular Formula	C17H23N3O6S2
Exact Mass	429.102828 g/mol

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SpectraBase Spectrum ID	FXTpjcr3Qia
Name	3-isothiazolidinone, 2-[4-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]-4,4-dimethyl-, 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/C17H23N3O6S2/c1-13(21)18-8-10-19(11-9-18)28(25,26)15-6-4-14(5-7-15)20-16(22)17(2,3)12-27(20,23)24/h4-7H,8-12H2,1-3H3
InChIKey	GKEQQIWBMMJCQL-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8726
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: F33580; Labnumber: CHEKAN-00010