| SpectraBase Spectrum ID |
BKd95qitFLE |
| Name |
(6Z)-6-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.118752663 u |
| Formula |
C21H21N5OS2 |
| InChI |
InChI=1S/C21H21N5OS2/c1-11-7-6-8-12(2)17(11)25-13(3)9-15(14(25)4)10-16-18(22)26-20(23-19(16)27)29-24-21(26)28-5/h6-10,22H,1-5H3/b16-10-,22-18? |
| InChIKey |
AKSWPJYLRRSAED-OXMFYWCOSA-N |
| Molecular Weight |
423.553 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_175 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259833 |
![(6Z)-6-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-](/api/spectrum/BKd95qitFLE/structure.png?h=300&w=458 "(6Z)-6-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-")
