![N-(2-chlorobenzyl)-6-(1-[2-(dipropylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide](/api/spectrum/I9oOz2v7bfn/structure.png?h=300&w=458 "N-(2-chlorobenzyl)-6-(1-[2-(dipropylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide")
| SpectraBase Compound ID | K5mHdCTRcEn |
|---|---|
| InChI | InChI=1S/C27H35ClN4O4S/c1-3-14-30(15-4-2)24(34)19-32-22-13-17-37-25(22)26(35)31(27(32)36)16-9-5-6-12-23(33)29-18-20-10-7-8-11-21(20)28/h7-8,10-11,13,17H,3-6,9,12,14-16,18-19H2,1-2H3,(H,29,33) |
| InChIKey | IKONOCVTCWZVRW-UHFFFAOYSA-N |
| Mol Weight | 547.1 g/mol |
| Molecular Formula | C27H35ClN4O4S |
| Exact Mass | 546.206754 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | I9oOz2v7bfn |
|---|---|
| Name | N-(2-chlorobenzyl)-6-(1-[2-(dipropylamino)-2-oxoethyl]-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 | 546.206754493 u |
| Formula | C27H35ClN4O4S |
| InChI | InChI=1S/C27H35ClN4O4S/c1-3-14-30(15-4-2)24(34)19-32-22-13-17-37-25(22)26(35)31(27(32)36)16-9-5-6-12-23(33)29-18-20-10-7-8-11-21(20)28/h7-8,10-11,13,17H,3-6,9,12,14-16,18-19H2,1-2H3,(H,29,33) |
| InChIKey | IKONOCVTCWZVRW-UHFFFAOYSA-N |
| Molecular Weight | 547.114 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6775 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12329124 |