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3-pyridinecarboxamide, 5-cyano-1,4-dihydro-2-methyl-6-[[2-oxo-2-[(4-phenoxyphenyl)amino]ethyl]thio]-N,4-diphenyl-
SpectraBase Compound ID EvpM9R8BSIz
InChI InChI=1S/C34H28N4O3S/c1-23-31(33(40)38-25-13-7-3-8-14-25)32(24-11-5-2-6-12-24)29(21-35)34(36-23)42-22-30(39)37-26-17-19-28(20-18-26)41-27-15-9-4-10-16-27/h2-20,32,36H,22H2,1H3,(H,37,39)(H,38,40)
InChIKey MGTBUBWROCABFW-UHFFFAOYSA-N
Mol Weight 572.7 g/mol
Molecular Formula C34H28N4O3S
Exact Mass 572.188212 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1rN9VOmx0u3
Name 3-pyridinecarboxamide, 5-cyano-1,4-dihydro-2-methyl-6-[[2-oxo-2-[(4-phenoxyphenyl)amino]ethyl]thio]-N,4-diphenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 572.188211949 u
Formula C34H28N4O3S
InChI InChI=1S/C34H28N4O3S/c1-23-31(33(40)38-25-13-7-3-8-14-25)32(24-11-5-2-6-12-24)29(21-35)34(36-23)42-22-30(39)37-26-17-19-28(20-18-26)41-27-15-9-4-10-16-27/h2-20,32,36H,22H2,1H3,(H,37,39)(H,38,40)
InChIKey MGTBUBWROCABFW-UHFFFAOYSA-N
Molecular Weight 572.683 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10526
Solvent DMSO-d6
Source Vendor ID: NMR/10251800; Lab Info: KR; Lab Number: KR-KV00168