| SpectraBase Spectrum ID |
4LGV4q2BWwP |
| Name |
3-pyridinecarboxamide, 5-cyano-1,4-dihydro-6-[[2-[(4-iodophenyl)amino]-2-oxoethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
612.015063278 u |
| Formula |
C26H21IN4O2S2 |
| InChI |
InChI=1S/C26H21IN4O2S2/c1-16-23(25(33)31-18-6-3-2-4-7-18)24(21-8-5-13-34-21)20(14-28)26(29-16)35-15-22(32)30-19-11-9-17(27)10-12-19/h2-13,24,29H,15H2,1H3,(H,30,32)(H,31,33) |
| InChIKey |
TWZJAAVAHKZDOC-UHFFFAOYSA-N |
| Molecular Weight |
612.504 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7727 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10231927; Lab Info: KR; Lab Number: KR-KC00087 |
| Temperature |
23.85 °C |
![3-pyridinecarboxamide, 5-cyano-1,4-dihydro-6-[[2-[(4-iodophenyl)amino]-2-oxoethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-](/api/spectrum/4LGV4q2BWwP/structure.png?h=300&w=458 "3-pyridinecarboxamide, 5-cyano-1,4-dihydro-6-[[2-[(4-iodophenyl)amino]-2-oxoethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-")
