SpectraBase Spectrum ID |
I1l20hSmhDL |
Name |
N-(1,3-benzodioxol-5-yl)-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}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/C28H28N4O3S/c1-18-5-12-22(13-6-18)32-26(19-7-9-20(10-8-19)28(2,3)4)30-31-27(32)36-16-25(33)29-21-11-14-23-24(15-21)35-17-34-23/h5-15H,16-17H2,1-4H3,(H,29,33) |
InChIKey |
PKHWRTSSGXUGKQ-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_3857 |
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: D98148; Labnumber: GRES-16505; SBI_ID: SBI-003859 |
Temperature |
318 °C |