| SpectraBase Spectrum ID |
53NJ9qa1I4t |
| Name |
4-{2,5-dimethyl-3-[(Z)-(1-methyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid |
| 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/C19H17N3O4S/c1-10-8-13(9-15-16(23)20-19(27)21(3)17(15)24)11(2)22(10)14-6-4-12(5-7-14)18(25)26/h4-9H,1-3H3,(H,25,26)(H,20,23,27)/b15-9- |
| InChIKey |
MLMYFMPQZHJXTK-DHDCSXOGSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_22797 |
| 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: D35826; Labnumber: SPDEM4-15181; SBI_ID: SBI-022801 |
| Synonyms |
4-{2,5-dimethyl-3-[(1-methyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid |
| Temperature |
308 °C |
![4-{2,5-dimethyl-3-[(Z)-(1-methyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid](/api/spectrum/53NJ9qa1I4t/structure.png?h=300&w=458 "4-{2,5-dimethyl-3-[(Z)-(1-methyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid")
