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2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-phenyl-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}propanamide
SpectraBase Compound ID 9Zrya1P1doc
InChI InChI=1S/C27H27N5O5S/c33-24(30-19-11-13-20(14-12-19)38(36,37)31-27-28-15-6-16-29-27)23(17-18-7-2-1-3-8-18)32-25(34)21-9-4-5-10-22(21)26(32)35/h1-3,6-8,11-16,21-23H,4-5,9-10,17H2,(H,30,33)(H,28,29,31)
InChIKey XVQKDXYRBZICOZ-UHFFFAOYSA-N
Mol Weight 533.6 g/mol
Molecular Formula C27H27N5O5S
Exact Mass 533.17329 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JLjfCKpNu0x
Name 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-phenyl-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}propanamide
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/C27H27N5O5S/c33-24(30-19-11-13-20(14-12-19)38(36,37)31-27-28-15-6-16-29-27)23(17-18-7-2-1-3-8-18)32-25(34)21-9-4-5-10-22(21)26(32)35/h1-3,6-8,11-16,21-23H,4-5,9-10,17H2,(H,30,33)(H,28,29,31)
InChIKey XVQKDXYRBZICOZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7420
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: 128265; Labnumber: VGU-15396; VK_ID: VK-007424
Temperature 318 °C