SpectraBase Spectrum ID |
36w0bSC867t |
Name |
Benzamide, N-[5-[[(2-chlorophenyl)methyl]thio]-1,3,4-thiadiazol-2-yl]-2-methoxy-3-methyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
405.037246813 u |
Formula |
C18H16ClN3O2S2 |
InChI |
InChI=1S/C18H16ClN3O2S2/c1-11-6-5-8-13(15(11)24-2)16(23)20-17-21-22-18(26-17)25-10-12-7-3-4-9-14(12)19/h3-9H,10H2,1-2H3,(H,20,21,23) |
InChIKey |
DWBKUUVRTAMMOY-UHFFFAOYSA-N |
Molecular Weight |
405.918 g/mol |
SMILES |
C(C1=CC=CC(=C1OC)C)(=O)NC1=NN=C(S1)SCC=1C(=CC=CC1)Cl |