SpectraBase Spectrum ID |
4oDJWOcGLRI |
Name |
3-pyridinecarboxamide, 5-cyano-6-[[2-[(4-ethylphenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
528.183126568 u |
Formula |
C29H28N4O4S |
InChI |
InChI=1S/C29H28N4O4S/c1-4-19-11-13-20(14-12-19)32-25(34)17-38-29-21(16-30)27(24-10-7-15-37-24)26(18(2)31-29)28(35)33-22-8-5-6-9-23(22)36-3/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35) |
InChIKey |
TUGPAAMVYDMINJ-UHFFFAOYSA-N |
Molecular Weight |
528.627 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10550 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251842; Lab Info: KR; Lab Number: KR-KV00219 |