| SpectraBase Spectrum ID |
2mZZ6JDdU2R |
| Name |
Ethyl 2-({[2-(4-methoxyphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[B]thiophene-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
514.192628624 u |
| Formula |
C30H30N2O4S |
| InChI |
InChI=1S/C30H30N2O4S/c1-3-36-30(34)27-22-11-6-4-5-7-13-26(22)37-29(27)32-28(33)23-18-25(19-14-16-20(35-2)17-15-19)31-24-12-9-8-10-21(23)24/h8-10,12,14-18H,3-7,11,13H2,1-2H3,(H,32,33) |
| InChIKey |
ZVYHAAAFUWNTAB-UHFFFAOYSA-N |
| Molecular Weight |
514.640 g/mol |
| SMILES |
N(C1=C(C=2CCCCCCC2S1)C(=O)OCC)C(C=1C=C(C2=CC=C(OC)C=C2)N=C2C1C=CC=C2)=O |
![Ethyl 2-({[2-(4-methoxyphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[B]thiophene-3-carboxylate](/api/spectrum/2mZZ6JDdU2R/structure.png?h=300&w=458 "Ethyl 2-({[2-(4-methoxyphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[B]thiophene-3-carboxylate")
