| SpectraBase Spectrum ID |
3X3fpL4lPGs |
| Name |
methyl 3-amino-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
466.960911287 u |
| Formula |
C17H14BrN3O4S2 |
| InChI |
InChI=1S/C17H14BrN3O4S2/c1-8-12-14(27-13(8)16(24)25-2)20-17(21(19)15(12)23)26-7-11(22)9-3-5-10(18)6-4-9/h3-6H,7,19H2,1-2H3 |
| InChIKey |
KLQDLWDPWLJXMT-UHFFFAOYSA-N |
| Molecular Weight |
468.340 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_7122 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12329663 |
![methyl 3-amino-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate](/api/spectrum/3X3fpL4lPGs/structure.png?h=300&w=458 "methyl 3-amino-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate")
