SpectraBase Spectrum ID |
BGNyQkeevAL |
Name |
2-{[({[2-(3-isobutoxyphenyl)-4-quinolinyl]carbonyl}amino)carbothioyl]amino}benzoic acid |
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/C28H25N3O4S/c1-17(2)16-35-19-9-7-8-18(14-19)25-15-22(20-10-3-5-12-23(20)29-25)26(32)31-28(36)30-24-13-6-4-11-21(24)27(33)34/h3-15,17H,16H2,1-2H3,(H,33,34)(H2,30,31,32,36) |
InChIKey |
OEORQWKUUVGDEU-UHFFFAOYSA-N |
NMR Offset |
15.3537 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_10822 |
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: 1004038; UBI_ID: UBI-010825 |
Temperature |
308 °C |