| SpectraBase Spectrum ID |
KZTa56sHaT3 |
| Name |
(4E)-2-(1,3-benzothiazol-2-yl)-4-(4-fluorobenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C25H18FN3OS2/c1-16-6-12-19(13-7-16)31-15-22-20(14-17-8-10-18(26)11-9-17)24(30)29(28-22)25-27-21-4-2-3-5-23(21)32-25/h2-14H,15H2,1H3/b20-14+ |
| InChIKey |
PQDDITXBNZSHIT-XSFVSMFZSA-N |
| NMR Offset |
14.9921 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI-VK_18310_463 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: 602311VOR8-8611; Labnumber: 602311VOR8-8611; VK_ID: VK-000464 |
| Synonyms |
2-(1,3-benzothiazol-2-yl)-4-(4-fluorobenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one |
| Temperature |
313 °C |
![(4E)-2-(1,3-benzothiazol-2-yl)-4-(4-fluorobenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one](/api/spectrum/KZTa56sHaT3/structure.png?h=300&w=458 "(4E)-2-(1,3-benzothiazol-2-yl)-4-(4-fluorobenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one")
