![N-{3-[4-(3-chlorophenyl)-1-piperazinyl]propyl}-2-(4-oxo-2-thioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide](/api/spectrum/7XiOXTLjYdv/structure.png?h=300&w=458 "N-{3-[4-(3-chlorophenyl)-1-piperazinyl]propyl}-2-(4-oxo-2-thioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide")
| SpectraBase Compound ID | 2uqXk9EsO0l |
|---|---|
| InChI | InChI=1S/C22H25ClN6O2S/c23-16-4-1-5-17(14-16)28-12-10-27(11-13-28)9-3-8-24-19(30)15-29-21(31)18-6-2-7-25-20(18)26-22(29)32/h1-2,4-7,14H,3,8-13,15H2,(H,24,30)(H,25,26,32) |
| InChIKey | UBUYSODLKCVMAZ-UHFFFAOYSA-N |
| Mol Weight | 473.0 g/mol |
| Molecular Formula | C22H25ClN6O2S |
| Exact Mass | 472.144823 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 7XiOXTLjYdv |
|---|---|
| Name | N-{3-[4-(3-chlorophenyl)-1-piperazinyl]propyl}-2-(4-oxo-2-thioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 472.144822941 u |
| Formula | C22H25ClN6O2S |
| InChI | InChI=1S/C22H25ClN6O2S/c23-16-4-1-5-17(14-16)28-12-10-27(11-13-28)9-3-8-24-19(30)15-29-21(31)18-6-2-7-25-20(18)26-22(29)32/h1-2,4-7,14H,3,8-13,15H2,(H,24,30)(H,25,26,32) |
| InChIKey | UBUYSODLKCVMAZ-UHFFFAOYSA-N |
| Molecular Weight | 472.995 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_3855 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12308390 |