| SpectraBase Spectrum ID |
3jo8gezI2MO |
| Name |
2,8-Dithia-14, 94-diamino-5-oxa-1-(2,5),9(5,2)-di(3-oxa-1,2,4-triazola)-cyclotetradecaphane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22N8O3S2 |
| InChI |
InChI=1S/C13H22N8O3S2/c14-20-10-16-18(12(20)22)4-2-1-3-5-19-13(23)21(15)11(17-19)26-9-7-24-6-8-25-10/h1-9,14-15H2 |
| InChIKey |
NAZHDLGLNVWFKU-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/hc.20211 |
| Molecular Weight |
402.492 g/mol |
| SMILES |
NN1C=2SCCOCCSC=3N(C(N(CCCCCN(C1=O)N2)N3)=O)N |
| SPLASH |
splash10-0f6x-9320800000-7092a36720b31259f152 |
| Source of Spectrum |
HAC-17-335-9 |
| Synonyms |
(10E,18E)-9,19-diamino-14-oxa-11,17-dithia-1,7,9,19,21,22-hexaazatricyclo[16.2.1.1(7,10)]docosa-10(22),18(21)-diene-8,20-dione |
| Wiley ID |
1783660 |
