| SpectraBase Spectrum ID |
BIo5nN1wj77 |
| Name |
ethyl 2-{3-[(Z)-(1-allyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C25H27N3O4S2/c1-5-11-27-22(30)18(21(29)26-25(27)33)13-16-12-14(3)28(15(16)4)23-20(24(31)32-6-2)17-9-7-8-10-19(17)34-23/h5,12-13H,1,6-11H2,2-4H3,(H,26,29,33)/b18-13- |
| InChIKey |
WLMOLZKZPBJXAJ-AQTBWJFISA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_1471 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: C96301; Labnumber: SPDEM2-0929; SBI_ID: SBI-001473 |
| Synonyms |
ethyl 2-{3-[(1-allyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Temperature |
318 °C |
![ethyl 2-{3-[(Z)-(1-allyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate](/api/spectrum/BIo5nN1wj77/structure.png?h=300&w=458 "ethyl 2-{3-[(Z)-(1-allyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
