SpectraBase Spectrum ID |
1wqO2Vh5SLY |
Name |
7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-propyl-, |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.131839886 u |
Formula |
C23H21FN4O3S |
InChI |
InChI=1S/C23H21FN4O3S/c1-3-6-20-27-28-21(25)16(22(29)26-23(28)32-20)11-14-9-10-18(19(12-14)30-2)31-13-15-7-4-5-8-17(15)24/h4-5,7-12,25H,3,6,13H2,1-2H3/b16-11-,25-21? |
InChIKey |
DJWOYEKRQIJJAG-HPFDFQMNSA-N |
Molecular Weight |
452.504 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15586 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10033553; Lab Info: CEP; Lab Number: CEP-6700250 |