| SpectraBase Spectrum ID |
H587BOZ8s6t |
| Name |
3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-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 |
558.149239616 u |
| Formula |
C30H27ClN4O3S |
| InChI |
InChI=1S/C30H27ClN4O3S/c1-18-13-14-21(15-23(18)31)34-26(36)17-39-30-22(16-32)28(20-9-5-4-6-10-20)27(19(2)33-30)29(37)35-24-11-7-8-12-25(24)38-3/h4-15,28,33H,17H2,1-3H3,(H,34,36)(H,35,37) |
| InChIKey |
GYGPVACCAJACFR-UHFFFAOYSA-N |
| Molecular Weight |
559.084 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6057 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10211928; Lab Info: KR; Lab Number: KR-KSG1G39 |
| Temperature |
23.85 °C |
![3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl-](/api/spectrum/H587BOZ8s6t/structure.png?h=300&w=458 "3-pyridinecarboxamide, 6-[[2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl-")
