| SpectraBase Spectrum ID |
BcBrSpdtAF1 |
| Name |
(6Z)-5-imino-2-isobutyl-6-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-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 |
424.102768246 u |
| Formula |
C21H20N4O2S2 |
| InChI |
InChI=1S/C21H20N4O2S2/c1-12(2)10-17-24-25-19(22)16(20(26)23-21(25)29-17)11-14-6-9-18(27-14)28-15-7-4-13(3)5-8-15/h4-9,11-12,22H,10H2,1-3H3/b16-11-,22-19? |
| InChIKey |
KTDLRBRNXKPBRM-JTKJEDPUSA-N |
| Molecular Weight |
424.537 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_20 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259667 |
![(6Z)-5-imino-2-isobutyl-6-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one](/api/spectrum/BcBrSpdtAF1/structure.png?h=300&w=458 "(6Z)-5-imino-2-isobutyl-6-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
