SpectraBase Spectrum ID |
E8orMRkkseb |
Name |
2-(4-Bromobenzoyl)-3-(4-methoxyphenyl)-6-phenyl-2,3-dihydro-4H-thiazolo[2,3-b][1,3,4]thiadiazin-5-ium bromide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H20Br2N2O2S2 |
InChI |
InChI=1S/C25H20BrN2O2S2.BrH/c1-30-20-13-9-17(10-14-20)22-24(23(29)18-7-11-19(26)12-8-18)32-25-28(27-22)21(15-31-25)16-5-3-2-4-6-16;/h2-15,22,24,27H,1H3;1H/q+1;/p-1 |
InChIKey |
OTOICBXYLMZNIX-UHFFFAOYSA-M |
Molecular Weight |
604.375 g/mol |
SMILES |
[Br-].N1C(C(Sc2[n+]1c(cs2)-c1ccccc1)C(c1ccc(Br)cc1)=O)c1ccc(OC)cc1 |
SPLASH |
splash10-0540-0900000000-54e836f166194771c7f3 |
Source of Spectrum |
SO-0-731-7 |
Synonyms |
7-(4-bromobenzoyl)-6-(4-methoxyphenyl)-3-phenyl-6,7-dihydro-5H-[1,3]thiazolo[2,3-b][1,3,4]thiadiazin-4-ium bromide |
Wiley ID |
1540143 |