| SpectraBase Spectrum ID |
4WpTRNWHsFd |
| Name |
N,N'-(dimethylmalonyl)-2,11-dithia-19,20-diaza-[3.3.2[(1,4)(1,4)(1,4)cyclophane |
| CAS Registry Number |
125686-36-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H26N2O2S2 |
| InChI |
InChI=1S/C27H26N2O2S2/c1-27(2)25(30)28-23-11-7-21(8-12-23)17-32-15-19-3-4-20(6-5-19)16-33-18-22-9-13-24(14-10-22)29(28)26(27)31/h3-14H,15-18H2,1-2H3 |
| InChIKey |
RFLLJQGHSBNHCL-UHFFFAOYSA-N |
| Molecular Weight |
474.637 g/mol |
| SMILES |
C1(N2N(C(C1(C)C)=O)c1ccc(CSCc3ccc(CSCc4ccc2cc4)cc3)cc1)=O |
| SPLASH |
splash10-00e9-0900700000-ca0ce4bdb25e02be8715 |
| Source of Spectrum |
K-123-1400-3 |
| Synonyms |
4,4-Dimethyl-12,19-dithia-2,6-diazapentacyclo[19.2.2.2(7,10).2(14,17).0(2,6)]nonacosa-1(23),7,9,14,16,21,24,26,28-nonaene-3,5-dione |
| Wiley ID |
1393892 |
