SpectraBase Spectrum ID |
74epmshb5Fv |
Name |
4-Tert-butyl-N-{5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}benzamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
381.151098165 u |
Formula |
C21H23N3O2S |
InChI |
InChI=1S/C21H23N3O2S/c1-14-5-11-17(12-6-14)26-13-18-23-24-20(27-18)22-19(25)15-7-9-16(10-8-15)21(2,3)4/h5-12H,13H2,1-4H3,(H,22,24,25) |
InChIKey |
USVMQKXUWRLJKG-UHFFFAOYSA-N |
Molecular Weight |
381.494 g/mol |
SMILES |
N(C=1SC(COC2=CC=C(C=C2)C)=NN1)C(C1=CC=C(C(C)(C)C)C=C1)=O |