| SpectraBase Spectrum ID |
DxJS8ICepnz |
| Name |
Benzamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[B]thien-2-yl)-4-(5-methyl-1H-1,2,3-triazol-1-yl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.115381360 u |
| Formula |
C19H17N5OS |
| InChI |
InChI=1S/C19H17N5OS/c1-12-11-21-23-24(12)14-8-6-13(7-9-14)18(25)22-19-16(10-20)15-4-2-3-5-17(15)26-19/h6-9,11H,2-5H2,1H3,(H,22,25) |
| InChIKey |
ZRIPVMKSWFVBPX-UHFFFAOYSA-N |
| Molecular Weight |
363.439 g/mol |
| SMILES |
N(C1=C(C=2CCCCC2S1)C#N)C(C1=CC=C(N2N=NC=C2C)C=C1)=O |