SpectraBase Spectrum ID |
CTaFtnx2oPF |
Name |
4-[1-(4-Chlorobenzyl)-1H-benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine, 1tms derivative |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
397.112564518 u |
Formula |
C19H20ClN5OSi |
InChI |
InChI=1S/C19H20ClN5OSi/c1-27(2,3)24-18-17(22-26-23-18)19-21-15-6-4-5-7-16(15)25(19)12-13-8-10-14(20)11-9-13/h4-11H,12H2,1-3H3,(H,23,24) |
InChIKey |
XSYFCXSMGZLZCG-UHFFFAOYSA-N |
Molecular Weight |
397.941 g/mol |
SMILES |
C1(Cl)=CC=C(C=C1)CN1C2=C(N=C1C1=NON=C1N[Si](C)(C)C)C=CC=C2 |