| SpectraBase Spectrum ID |
2pFQUmmHMMT |
| Name |
2-{[(4-chlorophenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[B]thiophene-3-carboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.080491351 u |
| Formula |
C18H19ClN2O3S |
| InChI |
InChI=1S/C18H19ClN2O3S/c19-11-6-8-12(9-7-11)24-10-15(22)21-18-16(17(20)23)13-4-2-1-3-5-14(13)25-18/h6-9H,1-5,10H2,(H2,20,23)(H,21,22) |
| InChIKey |
VERYVWIEMOJHBP-UHFFFAOYSA-N |
| Molecular Weight |
378.874 g/mol |
| SMILES |
NC(C1=C(SC=2CCCCCC12)NC(=O)COC1=CC=C(C=C1)Cl)=O |
![2-{[(4-chlorophenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide](/api/spectrum/2pFQUmmHMMT/structure.png?h=300&w=458 "2-{[(4-chlorophenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide")
