| SpectraBase Spectrum ID |
HBIapzb1oLl |
| Name |
o-[2-[(4-Bromophenyl)-carbamoyl]-5-chlorophenyl]-o,o-diethyl-phosphorothioate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
476.956606932 u |
| Formula |
C17H18BrClNO4PS |
| InChI |
InChI=1S/C17H18BrClNO4PS/c1-3-22-25(26,23-4-2)24-16-11-13(19)7-10-15(16)17(21)20-14-8-5-12(18)6-9-14/h5-11H,3-4H2,1-2H3,(H,20,21) |
| InChIKey |
OOERWFDTNBGBBF-UHFFFAOYSA-N |
| Molecular Weight |
478.725 g/mol |
| SMILES |
C=1(Cl)C=CC(=C(OP(=S)(OCC)OCC)C1)C(=O)NC1=CC=C(C=C1)Br |