For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-pyridinecarboxamide, 6-[[2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N,4-diphenyl-

View entire compound with spectra: 1 NMR

3-pyridinecarboxamide, 6-[[2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N,4-diphenyl-
SpectraBase Compound ID AyN5JCfFO5L
InChI InChI=1S/C29H25ClN4O3S/c1-18-26(28(36)33-21-11-7-4-8-12-21)27(19-9-5-3-6-10-19)22(16-31)29(32-18)38-17-25(35)34-23-15-20(30)13-14-24(23)37-2/h3-15,27,32H,17H2,1-2H3,(H,33,36)(H,34,35)
InChIKey NPBQRKLFHIKGCT-UHFFFAOYSA-N
Mol Weight 545.06 g/mol
Molecular Formula C29H25ClN4O3S
Exact Mass 544.13359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8ivnLlsSwJu
Name 3-pyridinecarboxamide, 6-[[2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-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 544.133589552 u
Formula C29H25ClN4O3S
InChI InChI=1S/C29H25ClN4O3S/c1-18-26(28(36)33-21-11-7-4-8-12-21)27(19-9-5-3-6-10-19)22(16-31)29(32-18)38-17-25(35)34-23-15-20(30)13-14-24(23)37-2/h3-15,27,32H,17H2,1-2H3,(H,33,36)(H,34,35)
InChIKey NPBQRKLFHIKGCT-UHFFFAOYSA-N
Molecular Weight 545.057 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10520
Solvent DMSO-d6
Source Vendor ID: NMR/10251791; Lab Info: KR; Lab Number: KR-KV00158