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3-pyridinecarboxamide, 5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-6-[[2-oxo-2-(phenylamino)ethyl]thio]-4-phenyl-
SpectraBase Compound ID DQ10tnzUykC
InChI InChI=1S/C29H26N4O3S/c1-19-26(28(35)33-23-15-9-10-16-24(23)36-2)27(20-11-5-3-6-12-20)22(17-30)29(31-19)37-18-25(34)32-21-13-7-4-8-14-21/h3-16,27,31H,18H2,1-2H3,(H,32,34)(H,33,35)
InChIKey JQJVFLKJFAUYJI-UHFFFAOYSA-N
Mol Weight 510.61 g/mol
Molecular Formula C29H26N4O3S
Exact Mass 510.172562 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGMY5Ha95T8
Name 3-pyridinecarboxamide, 5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-6-[[2-oxo-2-(phenylamino)ethyl]thio]-4-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.172561884 u
Formula C29H26N4O3S
InChI InChI=1S/C29H26N4O3S/c1-19-26(28(35)33-23-15-9-10-16-24(23)36-2)27(20-11-5-3-6-12-20)22(17-30)29(31-19)37-18-25(34)32-21-13-7-4-8-14-21/h3-16,27,31H,18H2,1-2H3,(H,32,34)(H,33,35)
InChIKey JQJVFLKJFAUYJI-UHFFFAOYSA-N
Molecular Weight 510.612 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6060
Solvent DMSO-d6
Source Vendor ID: NMR/10211933; Lab Info: KR; Lab Number: KR-KSG1G44
Temperature 23.85 °C