| SpectraBase Spectrum ID |
AP6eZOnzlV1 |
| Name |
3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-6-[[2-[(4-ethylphenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-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 |
542.154324997 u |
| Formula |
C30H27ClN4O2S |
| InChI |
InChI=1S/C30H27ClN4O2S/c1-3-20-9-13-23(14-10-20)34-26(36)18-38-30-25(17-32)28(21-7-5-4-6-8-21)27(19(2)33-30)29(37)35-24-15-11-22(31)12-16-24/h4-16,28,33H,3,18H2,1-2H3,(H,34,36)(H,35,37) |
| InChIKey |
JVJQOBZIHWNMSI-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_10546 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10251835; Lab Info: KR; Lab Number: KR-KV00208 |
![3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-6-[[2-[(4-ethylphenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-4-phenyl-](/api/spectrum/AP6eZOnzlV1/structure.png?h=300&w=458 "3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-6-[[2-[(4-ethylphenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-4-phenyl-")
