| SpectraBase Spectrum ID |
2AUkaQ8HHpx |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-[[[[5-[[(3,4-dimethoxybenzoyl)amino]methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-4,5,6,7-tetrahydro-, ethyl ester |
| 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/C33H37N5O7S2/c1-5-44-22-14-12-21(13-15-22)38-27(18-34-30(40)20-11-16-24(42-3)25(17-20)43-4)36-37-33(38)46-19-28(39)35-31-29(32(41)45-6-2)23-9-7-8-10-26(23)47-31/h11-17H,5-10,18-19H2,1-4H3,(H,34,40)(H,35,39) |
| InChIKey |
YKFISJNCHAMCOU-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_CB_8313_6675 |
| 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: NMR/10278686 |
![benzo[b]thiophene-3-carboxylic acid, 2-[[[[5-[[(3,4-dimethoxybenzoyl)amino]methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-4,5,6,7-tetrahydro-, ethyl ester](/api/spectrum/2AUkaQ8HHpx/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-[[[[5-[[(3,4-dimethoxybenzoyl)amino]methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-4,5,6,7-tetrahydro-, ethyl ester")
