| SpectraBase Spectrum ID |
Cc0ycXc1SUT |
| Name |
methyl 4-[({[4-allyl-5-(2-chlorophenyl)-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/C21H19ClN4O3S/c1-3-12-26-19(16-6-4-5-7-17(16)22)24-25-21(26)30-13-18(27)23-15-10-8-14(9-11-15)20(28)29-2/h3-11H,1,12-13H2,2H3,(H,23,27) |
| InChIKey |
SNZJUMJTTALVQN-UHFFFAOYSA-N |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_4366 |
| 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: D98886; Labnumber: GRES-27822; SBI_ID: SBI-004368 |
| Temperature |
306 °C |
![methyl 4-[({[4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate](/api/spectrum/Cc0ycXc1SUT/structure.png?h=300&w=458 "methyl 4-[({[4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate")
