SpectraBase Spectrum ID |
2FXPDWNTgQp |
Name |
N-[3-(4-methyl-5-{[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]benzamide |
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/C22H23N5O2S/c1-26-20(24-25-22(26)30-15-19(28)27-12-5-6-13-27)17-10-7-11-18(14-17)23-21(29)16-8-3-2-4-9-16/h2-4,7-11,14H,5-6,12-13,15H2,1H3,(H,23,29) |
InChIKey |
FEZIYYGBVFKXFQ-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_7255 |
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: D28921; Labnumber: SPKOL-4485; SBI_ID: SBI-007258 |
Temperature |
306 °C |