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ethanediamide, N~1~-(2,3-dihydro-1H-inden-2-yl)-N~2~-[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]-
SpectraBase Compound ID qiDOJCBmNq
InChI InChI=1S/C21H20N4O5S/c1-13-10-19(24-30-13)25-31(28,29)18-8-6-16(7-9-18)22-20(26)21(27)23-17-11-14-4-2-3-5-15(14)12-17/h2-10,17H,11-12H2,1H3,(H,22,26)(H,23,27)(H,24,25)
InChIKey VXUIMUAQPKBLCV-UHFFFAOYSA-N
Mol Weight 440.47 g/mol
Molecular Formula C21H20N4O5S
Exact Mass 440.115441 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8F9BeRNLx72
Name ethanediamide, N~1~-(2,3-dihydro-1H-inden-2-yl)-N~2~-[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]-
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/C21H20N4O5S/c1-13-10-19(24-30-13)25-31(28,29)18-8-6-16(7-9-18)22-20(26)21(27)23-17-11-14-4-2-3-5-15(14)12-17/h2-10,17H,11-12H2,1H3,(H,22,26)(H,23,27)(H,24,25)
InChIKey VXUIMUAQPKBLCV-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9752
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: F36251; Labnumber: NNA-V-32184