SpectraBase Spectrum ID |
CdYGEjkxEOW |
Name |
10-Benzyl-11-oxo-5a,6,7,8,9,9a,10,11-octahydrodibenzo[b,f][1,4]thiazepin-9a-(N-cyclohexylcarboxamide) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H32N2O2S |
InChI |
InChI=1S/C27H32N2O2S/c30-25-22-15-7-8-16-23(22)32-24-17-9-10-18-27(24,26(31)28-21-13-5-2-6-14-21)29(25)19-20-11-3-1-4-12-20/h1,3-4,7-8,11-12,15-16,21,24H,2,5-6,9-10,13-14,17-19H2,(H,28,31) |
InChIKey |
NLCGHCAVTKODQF-UHFFFAOYSA-N |
Molecular Weight |
448.625 g/mol |
SMILES |
N(C(C12N(C(c3ccccc3SC2CCCC1)=O)Cc1ccccc1)=O)C1CCCCC1 |
SPLASH |
splash10-00dl-4009000000-5e054e12b8e8bb0d9479 |
Source of Spectrum |
F-68-3318-11 |
Wiley ID |
1572363 |