SpectraBase Spectrum ID |
EEnk4ABHrk6 |
Name |
5-(Benzylamino)-4-(dimethylamino)-3-[(diethoxyphosphoryl)methyl]-2-(methylthio)thiazolium chloride |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H29ClN3O3PS2 |
InChI |
InChI=1S/C18H29N3O3PS2.ClH/c1-6-23-25(22,24-7-2)14-21-17(20(3)4)16(27-18(21)26-5)19-13-15-11-9-8-10-12-15;/h8-12,19H,6-7,13-14H2,1-5H3;1H/q+1;/p-1 |
InChIKey |
BJUSTFFWNKANDD-UHFFFAOYSA-M |
Molecular Weight |
465.995 g/mol |
SMILES |
[Cl-].N(c1c([n+](c(s1)SC)CP(=O)(OCC)OCC)N(C)C)Cc1ccccc1 |
SPLASH |
splash10-01p5-9300000000-cdde151bb93e923ba7d1 |
Source of Spectrum |
J-58-6027-6h |
Wiley ID |
1391378 |