| SpectraBase Spectrum ID |
6S3Rasr4Xde |
| Name |
acetamide, N-(3-chloro-4-methylphenyl)-2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-oxo-2-pyridinyl]thio]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
456.065903913 u |
| Formula |
C21H17ClN4O4S |
| InChI |
InChI=1S/C21H17ClN4O4S/c1-12-2-5-14(8-18(12)22)24-20(28)11-31-21-17(10-23)16(9-19(27)25-21)13-3-6-15(7-4-13)26(29)30/h2-8,16H,9,11H2,1H3,(H,24,28)(H,25,27) |
| InChIKey |
DVCRSFSWZINGRV-UHFFFAOYSA-N |
| Molecular Weight |
456.904 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_4024 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9264796; Lab Info: KR; Lab Number: KR-0000033 |
| Temperature |
29.85 °C |
![acetamide, N-(3-chloro-4-methylphenyl)-2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-oxo-2-pyridinyl]thio]-](/api/spectrum/6S3Rasr4Xde/structure.png?h=300&w=458 "acetamide, N-(3-chloro-4-methylphenyl)-2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-oxo-2-pyridinyl]thio]-")
