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5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methyl-2-furanyl)-6-(phenacylthio)-3-pyridinecarboxamide
SpectraBase Compound ID 6EsCzz0uOpa
InChI InChI=1S/C28H23N3O4S/c1-17-13-14-24(35-17)26-20(15-29)28(36-16-22(32)19-9-5-4-6-10-19)30-18(2)25(26)27(33)31-21-11-7-8-12-23(21)34-3/h4-14H,16H2,1-3H3,(H,31,33)
InChIKey IYWUUVKYNMLYCE-UHFFFAOYSA-N
Mol Weight 497.57 g/mol
Molecular Formula C28H23N3O4S
Exact Mass 497.140927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jr1Mxgn1X4Z
Name 3-pyridinecarboxamide, 5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methyl-2-furanyl)-6-[(2-oxo-2-phenylethyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 497.140927403 u
Formula C28H23N3O4S
InChI InChI=1S/C28H23N3O4S/c1-17-13-14-24(35-17)26-20(15-29)28(36-16-22(32)19-9-5-4-6-10-19)30-18(2)25(26)27(33)31-21-11-7-8-12-23(21)34-3/h4-14H,16H2,1-3H3,(H,31,33)
InChIKey IYWUUVKYNMLYCE-UHFFFAOYSA-N
Molecular Weight 497.569 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14532
Solvent DMSO-d6
Source Vendor ID: NMR/10231311; Lab Info: DVD; Lab Number: DVD-0000002