| SpectraBase Spectrum ID |
3nj9nqPs041 |
| Name |
3-Pyridinecarbonitrile, 4-(4-fluorophenyl)-2-[[2-(1-piperidinyl)ethyl]thio]-6-(2-thienyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.123918231 u |
| Formula |
C23H22FN3S2 |
| InChI |
InChI=1S/C23H22FN3S2/c24-18-8-6-17(7-9-18)19-15-21(22-5-4-13-28-22)26-23(20(19)16-25)29-14-12-27-10-2-1-3-11-27/h4-9,13,15H,1-3,10-12,14H2 |
| InChIKey |
MHYWHEFSUCPQLP-UHFFFAOYSA-N |
| Molecular Weight |
423.568 g/mol |
| SMILES |
C1(=C(N=C(C=C1C=1C=CC(=CC1)F)C=1SC=CC1)SCCN1CCCCC1)C#N |
![3-Pyridinecarbonitrile, 4-(4-fluorophenyl)-2-[[2-(1-piperidinyl)ethyl]thio]-6-(2-thienyl)-](/api/spectrum/3nj9nqPs041/structure.png?h=300&w=458 "3-Pyridinecarbonitrile, 4-(4-fluorophenyl)-2-[[2-(1-piperidinyl)ethyl]thio]-6-(2-thienyl)-")
