SpectraBase Spectrum ID |
7qsK4dY4Asd |
Name |
Thiazolidine-2-thione, 3-[4-(2-pyridyl)piperazin-1-yl]methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
294.097288944 u |
Formula |
C13H18N4S2 |
InChI |
InChI=1S/C13H18N4S2/c18-13-17(9-10-19-13)11-15-5-7-16(8-6-15)12-3-1-2-4-14-12/h1-4H,5-11H2 |
InChIKey |
XNLWYWFGLZMUMN-UHFFFAOYSA-N |
Molecular Weight |
294.435 g/mol |
SMILES |
C1CN(C(S1)=S)CN1CCN(C2=CC=CC=N2)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864718 |