| SpectraBase Spectrum ID |
aUH8KJyIQv |
| Name |
Ethyl 2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[B]thiophene-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.182063941 u |
| Formula |
C29H28N2O3S |
| InChI |
InChI=1S/C29H28N2O3S/c1-3-34-29(33)26-21-13-5-4-6-15-25(21)35-28(26)31-27(32)22-17-24(19-11-9-10-18(2)16-19)30-23-14-8-7-12-20(22)23/h7-12,14,16-17H,3-6,13,15H2,1-2H3,(H,31,32) |
| InChIKey |
DBBCLEOMBNWDJF-UHFFFAOYSA-N |
| Molecular Weight |
484.614 g/mol |
| SMILES |
N(C1=C(C=2CCCCCC2S1)C(=O)OCC)C(C=1C=C(C2=CC(C)=CC=C2)N=C2C1C=CC=C2)=O |
![ethyl 2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate](/api/spectrum/aUH8KJyIQv/structure.png?h=300&w=458 "ethyl 2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate")
