SpectraBase Spectrum ID |
EI335HwXYtT |
Name |
N-(3-Cyano-4,5,6,7-tetrahydrobenzo[B]thiophen-2-yl)-2-fluorobenzamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
300.073262383 u |
Formula |
C16H13FN2OS |
InChI |
InChI=1S/C16H13FN2OS/c17-13-7-3-1-6-11(13)15(20)19-16-12(9-18)10-5-2-4-8-14(10)21-16/h1,3,6-7H,2,4-5,8H2,(H,19,20) |
InChIKey |
YVYPYORTKAIUGJ-UHFFFAOYSA-N |
Molecular Weight |
300.351 g/mol |
SMILES |
C(#N)C=1C2=C(CCCC2)SC1NC(=O)C1=C(F)C=CC=C1 |