| SpectraBase Spectrum ID |
J4jVrbPxirN |
| Name |
3,3,8-Trimethyl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[B,E][1,4]diazepin-1-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.145284509 u |
| Formula |
C20H22N2OS |
| InChI |
InChI=1S/C20H22N2OS/c1-12-6-7-13-14(9-12)22-19(17-5-4-8-24-17)18-15(21-13)10-20(2,3)11-16(18)23/h4-9,19,21-22H,10-11H2,1-3H3 |
| InChIKey |
YIDFNWAMPSEXAP-UHFFFAOYSA-N |
| SMILES |
N1C=2C=CC(=CC2NC(C2=C1CC(CC2=O)(C)C)C=1SC=CC1)C |
![3,3,8-trimethyl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one](/api/spectrum/J4jVrbPxirN/structure.png?h=300&w=458 "3,3,8-trimethyl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one")
