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3-pyridinecarboxamide, 2-amino-5-cyano-6-[[2-(4-methylphenyl)-2-oxoethyl]thio]-N-phenyl-
SpectraBase Compound ID 7WpZ5IVvfcW
InChI InChI=1S/C22H18N4O2S/c1-14-7-9-15(10-8-14)19(27)13-29-22-16(12-23)11-18(20(24)26-22)21(28)25-17-5-3-2-4-6-17/h2-11H,13H2,1H3,(H2,24,26)(H,25,28)
InChIKey DKVWKJFSESHKIY-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C22H18N4O2S
Exact Mass 402.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6uiFxzFAiwM
Name 3-pyridinecarboxamide, 2-amino-5-cyano-6-[[2-(4-methylphenyl)-2-oxoethyl]thio]-N-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/C22H18N4O2S/c1-14-7-9-15(10-8-14)19(27)13-29-22-16(12-23)11-18(20(24)26-22)21(28)25-17-5-3-2-4-6-17/h2-11H,13H2,1H3,(H2,24,26)(H,25,28)
InChIKey DKVWKJFSESHKIY-UHFFFAOYSA-N
NMR Offset 16.0106
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5838
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: NMR/9301817; Labnumber: DVD-0000140