SpectraBase Compound ID | I1gjOJ8a0sD |
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InChI | InChI=1S/C26H28N4O3S2/c1-33-19-9-6-8-18(16-19)27-22(31)17-34-26-28-23-20-10-2-3-11-21(20)35-24(23)25(32)30(26)15-7-14-29-12-4-5-13-29/h2-3,6,8-11,16H,4-5,7,12-15,17H2,1H3,(H,27,31) |
InChIKey | PIQIJNQJNIWWAK-UHFFFAOYSA-N |
Mol Weight | 508.66 g/mol |
Molecular Formula | C26H28N4O3S2 |
Exact Mass | 508.160283 g/mol |
SpectraBase Spectrum ID | 5gYDYsVag4U |
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Name | N-(3-methoxyphenyl)-2-({4-oxo-3-[3-(1-pyrrolidinyl)propyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)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 | 508.160283123 u |
Formula | C26H28N4O3S2 |
InChI | InChI=1S/C26H28N4O3S2/c1-33-19-9-6-8-18(16-19)27-22(31)17-34-26-28-23-20-10-2-3-11-21(20)35-24(23)25(32)30(26)15-7-14-29-12-4-5-13-29/h2-3,6,8-11,16H,4-5,7,12-15,17H2,1H3,(H,27,31) |
InChIKey | PIQIJNQJNIWWAK-UHFFFAOYSA-N |
Molecular Weight | 508.655 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_6631 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12328905 |