SpectraBase Spectrum ID |
1UPS9isOljC |
Name |
2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide |
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/C20H18F2N4OS/c1-3-9-26-19(14-6-4-5-13(2)10-14)24-25-20(26)28-12-18(27)23-15-7-8-16(21)17(22)11-15/h3-8,10-11H,1,9,12H2,2H3,(H,23,27) |
InChIKey |
ZBRGTVHPDIHDCK-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_11124 |
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: E06121; Labnumber: GRES-16408; SBI_ID: SBI-011127 |
Temperature |
306 °C |