| SpectraBase Spectrum ID |
5bsfwliZZuf |
| Name |
3-Ethoxycarbonylmethyl-5-(4-nitrophenyl)-2-phenylimino-3,6-dihydro-2H-1,3,4-thiadiazinium bromide |
| Alternate Name(s) |
(2E)-3-(2-ethoxy-2-oxoethyl)-5-(4-nitrophenyl)-2-(phenylimino)-3,6-dihydro-2H-1,3,4-thiadiazin-3-ium bromide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19BrN4O4S |
| InChI |
InChI=1S/C19H18N4O4S.BrH/c1-2-27-18(24)12-22-19(20-15-6-4-3-5-7-15)28-13-17(21-22)14-8-10-16(11-9-14)23(25)26;/h3-11H,2,12-13H2,1H3;1H/b20-19+; |
| InChIKey |
MNXQHBJHLWOQDS-RZLHGTIFSA-N |
| Molecular Weight |
479.349 g/mol |
| SMILES |
[Br-].[NH+]1(N=C(CS\C1=N/c1ccccc1)c1ccc(N(=O)=O)cc1)CC(=O)OCC |
| SPLASH |
splash10-002b-1900000000-04681d2c137c323b9f92 |
| Source of Spectrum |
SO-64-520-3 |
| Wiley ID |
1540742 |
