| SpectraBase Spectrum ID |
AGDhsfH9mzI |
| Name |
1,15-Diaza-3,4;12,13-dibenzo-8-oxa-16,18-pyridine-5,11-dithiacyclooctadecane-2,14-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H21N3O3S2 |
| InChI |
InChI=1S/C23H21N3O3S2/c27-22-18-5-1-3-7-20(18)30-11-9-29-10-12-31-21-8-4-2-6-19(21)23(28)26-17-13-16(25-22)14-24-15-17/h1-8,13-15H,9-12H2,(H,25,27)(H,26,28) |
| InChIKey |
AVFNCLGTDJKKBV-UHFFFAOYSA-N |
| Molecular Weight |
451.559 g/mol |
| SMILES |
N1c2cc(NC(c3c(SCCOCCSc4c(C1=O)cccc4)cccc3)=O)cnc2 |
| SPLASH |
splash10-0006-9000000000-251542d071d4cca288fd |
| Source of Spectrum |
C5-2004-603-9 |
| Wiley ID |
1616649 |
