| SpectraBase Spectrum ID |
2GVlApcGiW9 |
| Name |
methyl 2-{[({[2-(3-isobutoxyphenyl)-4-quinolinyl]carbonyl}amino)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| 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/C31H31N3O4S2/c1-18(2)17-38-20-10-8-9-19(15-20)25-16-23(21-11-4-6-13-24(21)32-25)28(35)33-31(39)34-29-27(30(36)37-3)22-12-5-7-14-26(22)40-29/h4,6,8-11,13,15-16,18H,5,7,12,14,17H2,1-3H3,(H2,33,34,35,39) |
| InChIKey |
ORXGELLJRMKUJS-UHFFFAOYSA-N |
| NMR Offset |
16.5281 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_10859 |
| 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: 1003508; UBI_ID: UBI-010862 |
| Temperature |
308 °C |
![methyl 2-{[({[2-(3-isobutoxyphenyl)-4-quinolinyl]carbonyl}amino)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate](/api/spectrum/2GVlApcGiW9/structure.png?h=300&w=458 "methyl 2-{[({[2-(3-isobutoxyphenyl)-4-quinolinyl]carbonyl}amino)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
