| SpectraBase Spectrum ID |
2zMynUHcOrf |
| Name |
Acetamide, 2-[[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridinyl]thio]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.050101839 u |
| Formula |
C22H16FN5OS3 |
| InChI |
InChI=1S/C22H16FN5OS3/c1-2-20-27-28-22(32-20)26-19(29)12-31-21-16(11-24)15(13-5-7-14(23)8-6-13)10-17(25-21)18-4-3-9-30-18/h3-10H,2,12H2,1H3,(H,26,28,29) |
| InChIKey |
GPSTWXCWTMJTQV-UHFFFAOYSA-N |
| Molecular Weight |
481.582 g/mol |
| SMILES |
N(C=1SC(CC)=NN1)C(=O)CSC1=C(C(C=2C=CC(=CC2)F)=CC(=N1)C=1SC=CC1)C#N |