| SpectraBase Spectrum ID |
KOYw7nR3uCp |
| Name |
3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N-(2-methylphenyl)-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 |
542.154324997 u |
| Formula |
C30H27ClN4O2S |
| InChI |
InChI=1S/C30H27ClN4O2S/c1-18-13-14-22(15-24(18)31)34-26(36)17-38-30-23(16-32)28(21-10-5-4-6-11-21)27(20(3)33-30)29(37)35-25-12-8-7-9-19(25)2/h4-15,28,33H,17H2,1-3H3,(H,34,36)(H,35,37) |
| InChIKey |
VCYVJSFLOHURPI-UHFFFAOYSA-N |
| Molecular Weight |
543.085 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_10536 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10251820; Lab Info: KR; Lab Number: KR-KV00189 |
![3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N-(2-methylphenyl)-4-phenyl-](/api/spectrum/KOYw7nR3uCp/structure.png?h=300&w=458 "3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N-(2-methylphenyl)-4-phenyl-")
