| SpectraBase Spectrum ID |
3AFJEX9uF7E |
| Name |
5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21BrN2O5S |
| InChI |
InChI=1S/C22H21BrN2O5S/c1-12-4-5-15(8-13(12)2)29-6-7-30-19-17(23)10-14(11-18(19)28-3)9-16-20(26)24-22(31)25-21(16)27/h4-5,8-11H,6-7H2,1-3H3,(H2,24,25,26,27,31) |
| InChIKey |
NQTAJNOQVWUJSE-UHFFFAOYSA-N |
| Molecular Weight |
505.383 g/mol |
| SMILES |
N1C(NC(C(C1=O)=Cc1cc(Br)c(c(c1)OC)OCCOc1cc(C)c(cc1)C)=O)=S |
| SPLASH |
splash10-0a4j-3900040000-24344f4adaf8a6475532 |
| Synonyms |
5-[[3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione
5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Wiley ID |
1436555 |
![5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone](/api/spectrum/3AFJEX9uF7E/structure.png?h=300&w=458 "5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone")
