3-isothiazolidinone, 2-[4-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-3-methylphenyl]-4-methyl-, 1,1-dioxide

SpectraBase Compound ID	1pI5YIZqmJH
InChI	InChI=1S/C19H20N2O5S2/c1-13-11-16(21-19(22)14(2)12-27(21,23)24)7-8-18(13)28(25,26)20-10-9-15-5-3-4-6-17(15)20/h3-8,11,14H,9-10,12H2,1-2H3
InChIKey	CLQCSSDHZMLHEW-UHFFFAOYSA-N Google Search
Mol Weight	420.5 g/mol
Molecular Formula	C19H20N2O5S2
Exact Mass	420.081364 g/mol

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SpectraBase Spectrum ID	K3TzBtYbtNC
Name	3-isothiazolidinone, 2-[4-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-3-methylphenyl]-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/C19H20N2O5S2/c1-13-11-16(21-19(22)14(2)12-27(21,23)24)7-8-18(13)28(25,26)20-10-9-15-5-3-4-6-17(15)20/h3-8,11,14H,9-10,12H2,1-2H3
InChIKey	CLQCSSDHZMLHEW-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8803
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: F33674; Labnumber: CHEKAN-00242