| SpectraBase Spectrum ID |
CK7jhwB5bLc |
| Name |
Methyl 3-{[(1-butyl-4-hydroxy-2-oxo-1,2-dihydro-3-quinolinyl)carbonyl]amino}-2-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.109292921 u |
| Formula |
C20H20N2O5S |
| InChI |
InChI=1S/C20H20N2O5S/c1-3-4-10-22-14-8-6-5-7-12(14)16(23)15(19(22)25)18(24)21-13-9-11-28-17(13)20(26)27-2/h5-9,11,23H,3-4,10H2,1-2H3,(H,21,24) |
| InChIKey |
VZKHTRXDEONOTJ-UHFFFAOYSA-N |
| Molecular Weight |
400.449 g/mol |
| SMILES |
OC=1C2=C(N(C(C1C(NC1=C(C(=O)OC)SC=C1)=O)=O)CCCC)C=CC=C2 |
![Methyl 3-{[(1-butyl-4-hydroxy-2-oxo-1,2-dihydro-3-quinolinyl)carbonyl]amino}-2-thiophenecarboxylate](/api/spectrum/CK7jhwB5bLc/structure.png?h=300&w=458 "Methyl 3-{[(1-butyl-4-hydroxy-2-oxo-1,2-dihydro-3-quinolinyl)carbonyl]amino}-2-thiophenecarboxylate")
