| SpectraBase Spectrum ID |
9NlaKtGsPBR |
| Name |
acetamide, 2-[[4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl]thio]-N-[2-[[2-oxo-2-(phenylamino)ethyl]thio]-6-benzothiazolyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
590.122852240 u |
| Formula |
C28H26N6O3S3 |
| InChI |
InChI=1S/C28H26N6O3S3/c1-18-8-6-7-11-22(18)37-15-24-32-33-27(34(24)2)38-16-25(35)30-20-12-13-21-23(14-20)40-28(31-21)39-17-26(36)29-19-9-4-3-5-10-19/h3-14H,15-17H2,1-2H3,(H,29,36)(H,30,35) |
| InChIKey |
PUGTYLAFFMXGBB-UHFFFAOYSA-N |
| Molecular Weight |
590.735 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2049 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8174949; Lab Info: LP; Lab Number: LP-0605873 |
| Temperature |
29.85 °C |
![acetamide, 2-[[4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl]thio]-N-[2-[[2-oxo-2-(phenylamino)ethyl]thio]-6-benzothiazolyl]-](/api/spectrum/9NlaKtGsPBR/structure.png?h=300&w=458 "acetamide, 2-[[4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl]thio]-N-[2-[[2-oxo-2-(phenylamino)ethyl]thio]-6-benzothiazolyl]-")
