| SpectraBase Spectrum ID |
5QuOJ3QzlCu |
| Name |
Propanamide, 3-[[1-(4-chlorophenyl)-1H-tetrazol-5-yl]thio]-N-(4-fluorophenyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.051337095 u |
| Formula |
C16H13ClFN5OS |
| InChI |
InChI=1S/C16H13ClFN5OS/c17-11-1-7-14(8-2-11)23-16(20-21-22-23)25-10-9-15(24)19-13-5-3-12(18)4-6-13/h1-8H,9-10H2,(H,19,24) |
| InChIKey |
JRSHKAANDFBBBK-UHFFFAOYSA-N |
| Molecular Weight |
377.825 g/mol |
| SMILES |
N(C(CCSC=1N(N=NN1)C1=CC=C(C=C1)Cl)=O)C1=CC=C(C=C1)F |