| SpectraBase Compound ID | KFhl1I2OTXq |
|---|---|
| InChI | InChI=1S/C14H22N4OS/c1-19-12-4-7-16-14(20)18-10-8-17(9-11-18)13-5-2-3-6-15-13/h2-3,5-6H,4,7-12H2,1H3,(H,16,20) |
| InChIKey | ASCRNJRLSSEFTG-UHFFFAOYSA-N |
| Mol Weight | 294.42 g/mol |
| Molecular Formula | C14H22N4OS |
| Exact Mass | 294.151433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C1zT9hpk2Kd |
|---|---|
| Name | N-(3-Methoxypropyl)-4-(2-pyridinyl)-1-piperazinecarbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.151432517 u |
| Formula | C14H22N4OS |
| InChI | InChI=1S/C14H22N4OS/c1-19-12-4-7-16-14(20)18-10-8-17(9-11-18)13-5-2-3-6-15-13/h2-3,5-6H,4,7-12H2,1H3,(H,16,20) |
| InChIKey | ASCRNJRLSSEFTG-UHFFFAOYSA-N |
| SMILES | N(C(N1CCN(CC1)C1=NC=CC=C1)=S)CCCOC |