![S-[5-(Thiazolidin-3-yl)pentyl]quinolin-2-thiol](/api/spectrum/C0IhHG125m0/structure.png?h=300&w=458 "S-[5-(Thiazolidin-3-yl)pentyl]quinolin-2-thiol")
| SpectraBase Compound ID | 2jqXS8JfXtm |
|---|---|
| InChI | InChI=1S/C17H22N2S2/c1(4-10-19-11-13-20-14-19)5-12-21-17-9-8-15-6-2-3-7-16(15)18-17/h2-3,6-9H,1,4-5,10-14H2 |
| InChIKey | QXWGCZMONNFRFM-UHFFFAOYSA-N |
| Mol Weight | 318.5 g/mol |
| Molecular Formula | C17H22N2S2 |
| Exact Mass | 318.122441 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C0IhHG125m0 |
|---|---|
| Name | S-[5-(Thiazolidin-3-yl)pentyl]quinolin-2-thiol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.122441064 u |
| Formula | C17H22N2S2 |
| InChI | InChI=1S/C17H22N2S2/c1(4-10-19-11-13-20-14-19)5-12-21-17-9-8-15-6-2-3-7-16(15)18-17/h2-3,6-9H,1,4-5,10-14H2 |
| InChIKey | QXWGCZMONNFRFM-UHFFFAOYSA-N |
| Molecular Weight | 318.497 g/mol |
| SMILES | C1SCCN1CCCCCSC1=NC2=C(C=CC=C2)C=C1 |