| SpectraBase Spectrum ID |
CKp6exCmVQz |
| Name |
5,6,6A,7-Tetrahydro-7-(2-thienyl)benzo[B]naphtho[1,2-E][1,4]thiazepine thiazepine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.080241899 u |
| Formula |
C21H17NS2 |
| InChI |
InChI=1S/C21H17NS2/c1-2-7-15-14(6-1)11-12-16-20(15)22-17-8-3-4-9-18(17)24-21(16)19-10-5-13-23-19/h1-10,13,16,21H,11-12H2 |
| InChIKey |
PQDKRXIRLBKQHZ-UHFFFAOYSA-N |
| Molecular Weight |
347.494 g/mol |
| SMILES |
C=12C=CC=CC1SC(C1CCC=3C=CC=CC3C1=N2)C=1SC=CC1 |
![5,6,6A,7-Tetrahydro-7-(2-thienyl)benzo[B]naphtho[1,2-E][1,4]thiazepine thiazepine](/api/spectrum/CKp6exCmVQz/structure.png?h=300&w=458 "5,6,6A,7-Tetrahydro-7-(2-thienyl)benzo[B]naphtho[1,2-E][1,4]thiazepine thiazepine")
