| SpectraBase Spectrum ID |
JA0D3FQsxY0 |
| Name |
3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[(1E)-1-[(4-chlorophenyl)imino]ethyl]-5-[[(4-chlorophenyl)thio]methyl]-1,2-dihydro- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
524.029908963 u |
| Formula |
C25H18Cl2N4OS2 |
| InChI |
InChI=1S/C25H18Cl2N4OS2/c1-15(28-18-10-6-16(26)7-11-18)23-21(14-33-19-12-8-17(27)9-13-19)30-31(24(23)32)25-29-20-4-2-3-5-22(20)34-25/h2-13,30H,14H2,1H3/b28-15+ |
| InChIKey |
CIHOKWFEZAISQO-RWPZCVJISA-N |
| Molecular Weight |
525.472 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_13317 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10260067; Lab Info: PRE; Lab Number: PRE-vgy09215 |
![3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[(1E)-1-[(4-chlorophenyl)imino]ethyl]-5-[[(4-chlorophenyl)thio]methyl]-1,2-dihydro-](/api/spectrum/JA0D3FQsxY0/structure.png?h=300&w=458 "3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[(1E)-1-[(4-chlorophenyl)imino]ethyl]-5-[[(4-chlorophenyl)thio]methyl]-1,2-dihydro-")
