SpectraBase Spectrum ID |
3tXVeySZUIN |
Name |
methyl 4-[({[5-(2-chlorophenyl)-4-(2-furylmethyl)-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/C23H19ClN4O4S/c1-31-22(30)15-8-10-16(11-9-15)25-20(29)14-33-23-27-26-21(18-6-2-3-7-19(18)24)28(23)13-17-5-4-12-32-17/h2-12H,13-14H2,1H3,(H,25,29) |
InChIKey |
MYNUFCMWMDIROI-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_14322 |
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: D98194; Labnumber: GRES-17187; SBI_ID: SBI-014325 |
Temperature |
318 °C |