SpectraBase Spectrum ID |
LlgkPFIzoGQ |
Name |
methyl 4-[({[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate |
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/C23H26N4O3S/c1-23(2,3)17-10-6-15(7-11-17)20-25-26-22(27(20)4)31-14-19(28)24-18-12-8-16(9-13-18)21(29)30-5/h6-13H,14H2,1-5H3,(H,24,28) |
InChIKey |
AYJVRWOHUNPXLO-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_4384 |
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: D98924; Labnumber: GRES-28563; SBI_ID: SBI-004386 |
Temperature |
306 °C |