| SpectraBase Spectrum ID |
JLOo8igTMs9 |
| Name |
4-[(Z)-(5-imino-3-(isobutylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]benzoic acid |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.066382736 u |
| Formula |
C17H16N4O3S2 |
| InChI |
InChI=1S/C17H16N4O3S2/c1-9(2)8-25-17-20-26-16-19-14(22)12(13(18)21(16)17)7-10-3-5-11(6-4-10)15(23)24/h3-7,9,18H,8H2,1-2H3,(H,23,24)/b12-7-,18-13? |
| InChIKey |
BWRBKCRFGILICY-NOOFILGISA-N |
| Molecular Weight |
388.460 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_199 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259860 |
![4-[(Z)-(5-imino-3-(isobutylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]benzoic acid](/api/spectrum/JLOo8igTMs9/structure.png?h=300&w=458 "4-[(Z)-(5-imino-3-(isobutylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]benzoic acid")
