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3-isothiazolidinone, 2-[4-methoxy-3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenyl]-4,4-dimethyl-, 1,1-dioxide
SpectraBase Compound ID 6FWD8Wxwloi
InChI InChI=1S/C21H26N4O6S2/c1-21(2)15-32(27,28)25(20(21)26)16-7-8-17(31-3)18(14-16)33(29,30)24-12-10-23(11-13-24)19-6-4-5-9-22-19/h4-9,14H,10-13,15H2,1-3H3
InChIKey PZQNQCRIYKPIDZ-UHFFFAOYSA-N
Mol Weight 494.58 g/mol
Molecular Formula C21H26N4O6S2
Exact Mass 494.129377 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID pjoA2twXPj
Name 3-isothiazolidinone, 2-[4-methoxy-3-[[4-(2-pyridinyl)-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/C21H26N4O6S2/c1-21(2)15-32(27,28)25(20(21)26)16-7-8-17(31-3)18(14-16)33(29,30)24-12-10-23(11-13-24)19-6-4-5-9-22-19/h4-9,14H,10-13,15H2,1-3H3
InChIKey PZQNQCRIYKPIDZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8910
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: F33813; Labnumber: CHEKAN-00671