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N-(4-{[(2,6-dimethyl-4-pyrimidinyl)amino]sulfonyl}phenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
SpectraBase Compound ID 6Ylp9o7VlbH
InChI InChI=1S/C22H18N4O5S/c1-13-11-20(24-14(2)23-13)26-32(29,30)17-9-7-16(8-10-17)25-21(27)19-12-15-5-3-4-6-18(15)22(28)31-19/h3-12H,1-2H3,(H,25,27)(H,23,24,26)
InChIKey KDKZOOPRILOBBK-UHFFFAOYSA-N
Mol Weight 450.47 g/mol
Molecular Formula C22H18N4O5S
Exact Mass 450.099791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Khnyicu2HJw
Name N-(4-{[(2,6-dimethyl-4-pyrimidinyl)amino]sulfonyl}phenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
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/C22H18N4O5S/c1-13-11-20(24-14(2)23-13)26-32(29,30)17-9-7-16(8-10-17)25-21(27)19-12-15-5-3-4-6-18(15)22(28)31-19/h3-12H,1-2H3,(H,25,27)(H,23,24,26)
InChIKey KDKZOOPRILOBBK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2590
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: UZI/8059519; UBI_ID: UBI-002591
Temperature 318 °C