| SpectraBase Spectrum ID |
9KBboTegYJD |
| Name |
(6Z)-6-{[1-(4-chlorophenyl)-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-one |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.048480202 u |
| Formula |
C19H16ClN5OS2 |
| InChI |
InChI=1S/C19H16ClN5OS2/c1-10-8-12(11(2)24(10)14-6-4-13(20)5-7-14)9-15-16(21)25-18(22-17(15)26)28-23-19(25)27-3/h4-9,21H,1-3H3/b15-9-,21-16? |
| InChIKey |
DIQBNIVOACKGBW-IAYHVCARSA-N |
| Molecular Weight |
429.944 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_177 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259835 |
![(6Z)-6-{[1-(4-chlorophenyl)-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-one](/api/spectrum/9KBboTegYJD/structure.png?h=300&w=458 "(6Z)-6-{[1-(4-chlorophenyl)-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-one")
