| SpectraBase Spectrum ID |
Eeqgkgceej7 |
| Name |
Acetic acid, [[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridinyl]thio]-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.040248176 u |
| Formula |
C19H13FN2O2S2 |
| InChI |
InChI=1S/C19H13FN2O2S2/c1-24-18(23)11-26-19-15(10-21)14(12-4-6-13(20)7-5-12)9-16(22-19)17-3-2-8-25-17/h2-9H,11H2,1H3 |
| InChIKey |
JUMFKKHZLUPADK-UHFFFAOYSA-N |
| Molecular Weight |
384.443 g/mol |
| SMILES |
C1(=C(N=C(C=C1C=1C=CC(=CC1)F)C=1SC=CC1)SCC(=O)OC)C#N |
![Acetic acid, [[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridinyl]thio]-, methyl ester](/api/spectrum/Eeqgkgceej7/structure.png?h=300&w=458 "Acetic acid, [[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridinyl]thio]-, methyl ester")
