![N-(2-chlorobenzyl)-6-(1-(2,5-dimethylbenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide](/api/spectrum/GrtOhoRN9cR/structure.png?h=300&w=458 "N-(2-chlorobenzyl)-6-(1-(2,5-dimethylbenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide")
| SpectraBase Compound ID | GXymeyoxcMB |
|---|---|
| InChI | InChI=1S/C28H30ClN3O3S/c1-19-11-12-20(2)22(16-19)18-32-24-13-15-36-26(24)27(34)31(28(32)35)14-7-3-4-10-25(33)30-17-21-8-5-6-9-23(21)29/h5-6,8-9,11-13,15-16H,3-4,7,10,14,17-18H2,1-2H3,(H,30,33) |
| InChIKey | NLTXOURACVZFPT-UHFFFAOYSA-N |
| Mol Weight | 524.08 g/mol |
| Molecular Formula | C28H30ClN3O3S |
| Exact Mass | 523.169641 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | GrtOhoRN9cR |
|---|---|
| Name | N-(2-chlorobenzyl)-6-(1-(2,5-dimethylbenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 523.169640709 u |
| Formula | C28H30ClN3O3S |
| InChI | InChI=1S/C28H30ClN3O3S/c1-19-11-12-20(2)22(16-19)18-32-24-13-15-36-26(24)27(34)31(28(32)35)14-7-3-4-10-25(33)30-17-21-8-5-6-9-23(21)29/h5-6,8-9,11-13,15-16H,3-4,7,10,14,17-18H2,1-2H3,(H,30,33) |
| InChIKey | NLTXOURACVZFPT-UHFFFAOYSA-N |
| Molecular Weight | 524.079 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6002 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12328026 |