| SpectraBase Spectrum ID |
4ACQ8JvXKG3 |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-[3-[(E)-(6-acetyl-5-(2-methoxy-1-naphthalenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2(3H)- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
679.217463646 u |
| Formula |
C38H37N3O5S2 |
| InChI |
InChI=1S/C38H37N3O5S2/c1-7-46-37(44)33-27-14-10-11-15-29(27)47-36(33)40-20(2)18-25(22(40)4)19-30-35(43)41-34(31(23(5)42)21(3)39-38(41)48-30)32-26-13-9-8-12-24(26)16-17-28(32)45-6/h8-9,12-13,16-19,34H,7,10-11,14-15H2,1-6H3/b30-19+ |
| InChIKey |
BYSXWVJIVSUMBX-NDZAJKAJSA-N |
| Molecular Weight |
679.850 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1617 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9216235; Lab Info: LD; Lab Number: LD-1000057 |
| Temperature |
29.85 °C |
![benzo[b]thiophene-3-carboxylic acid, 2-[3-[(E)-(6-acetyl-5-(2-methoxy-1-naphthalenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2(3H)-](/api/spectrum/4ACQ8JvXKG3/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-[3-[(E)-(6-acetyl-5-(2-methoxy-1-naphthalenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2(3H)-")
