| SpectraBase Spectrum ID |
FxkPVGvLftO |
| Name |
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl}benzamide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.146012784 u |
| Formula |
C26H23N3O3S |
| InChI |
InChI=1S/C26H23N3O3S/c1-13-2-9-18-19(12-27)24(33-20(18)10-13)28-23(30)14-5-7-17(8-6-14)29-25(31)21-15-3-4-16(11-15)22(21)26(29)32/h3-8,13,15-16,21-22H,2,9-11H2,1H3,(H,28,30) |
| InChIKey |
HNWRVDJSBDGEIL-UHFFFAOYSA-N |
| Molecular Weight |
457.548 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9735 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10025843; Lab Info: AI; Lab Number: AI-0000004 |
![N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl}benzamide](/api/spectrum/FxkPVGvLftO/structure.png?h=300&w=458 "N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl}benzamide")
