3-isothiazolidinone, 2-[3-[(3,4-dihydro-1(2H)-quinolinyl)sulfonyl]-4-methoxyphenyl]-4,4-dimethyl-, 1,1-dioxide

SpectraBase Compound ID	FEAA3rY9zhD
InChI	InChI=1S/C21H24N2O6S2/c1-21(2)14-30(25,26)23(20(21)24)16-10-11-18(29-3)19(13-16)31(27,28)22-12-6-8-15-7-4-5-9-17(15)22/h4-5,7,9-11,13H,6,8,12,14H2,1-3H3
InChIKey	IIPOYIRYIXIIJG-UHFFFAOYSA-N Google Search
Mol Weight	464.55 g/mol
Molecular Formula	C21H24N2O6S2
Exact Mass	464.107579 g/mol

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SpectraBase Spectrum ID	BVHW1HrvzGg
Name	3-isothiazolidinone, 2-[3-[(3,4-dihydro-1(2H)-quinolinyl)sulfonyl]-4-methoxyphenyl]-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/C21H24N2O6S2/c1-21(2)14-30(25,26)23(20(21)24)16-10-11-18(29-3)19(13-16)31(27,28)22-12-6-8-15-7-4-5-9-17(15)22/h4-5,7,9-11,13H,6,8,12,14H2,1-3H3
InChIKey	IIPOYIRYIXIIJG-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8918
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: F33821; Labnumber: CHEKAN-00686