SpectraBase Spectrum ID |
JV2XEHnZLDX |
Name |
(2E)-N-(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[B]thien-2-yl)-3-(2-thienyl)-2-propenamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.070405490 u |
Formula |
C17H16N2OS2 |
InChI |
InChI=1S/C17H16N2OS2/c18-11-14-13-6-2-1-3-7-15(13)22-17(14)19-16(20)9-8-12-5-4-10-21-12/h4-5,8-10H,1-3,6-7H2,(H,19,20)/b9-8+ |
InChIKey |
JBVJVNXBRXNNFC-CMDGGOBGSA-N |
Molecular Weight |
328.448 g/mol |
SMILES |
N(C1=C(C=2CCCCCC2S1)C#N)C(\C=C\C=1SC=CC1)=O |