| SpectraBase Spectrum ID |
IpDa9ycu3jU |
| Name |
2-Hydroxy-2-trifluoromethyl-3-[N-benzyl-N-acetylamido]-1,5-benzothiazepine-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17F3N2O3S |
| InChI |
InChI=1S/C19H17F3N2O3S/c1-12(25)24(11-13-7-3-2-4-8-13)16-17(26)23-14-9-5-6-10-15(14)28-18(16,27)19(20,21)22/h2-10,16,27H,11H2,1H3,(H,23,26) |
| InChIKey |
NWDWQJXCGRCDAV-UHFFFAOYSA-N |
| Molecular Weight |
410.411 g/mol |
| SMILES |
N1c2c(SC(C(C1=O)N(C(=O)C)Cc1ccccc1)(C(F)(F)F)O)cccc2 |
| SPLASH |
splash10-0006-9000000000-547c75bad56f9743209a |
| Source of Spectrum |
O1-55-1923-4 |
| Synonyms |
N-[2-hydroxy-4-oxo-2-(trifluoromethyl)-3,5-dihydro-1,5-benzothiazepin-3-yl]-N-(phenylmethyl)acetamide
N-benzyl-N-[2-hydroxy-4-oxo-2-(trifluoromethyl)-3,5-dihydro-1,5-benzothiazepin-3-yl]acetamide
N-[2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)-3,5-dihydro-1,5-benzothiazepin-3-yl]-N-(phenylmethyl)ethanamide |
| Wiley ID |
1591374 |
![2-Hydroxy-2-trifluoromethyl-3-[N-benzyl-N-acetylamido]-1,5-benzothiazepine-4-one](/api/spectrum/IpDa9ycu3jU/structure.png?h=300&w=458 "2-Hydroxy-2-trifluoromethyl-3-[N-benzyl-N-acetylamido]-1,5-benzothiazepine-4-one")
