![4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(p-methylbenzyl)thio]pyrimidine](/api/spectrum/B38PfYPhuZz/structure.png?h=300&w=458 "4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(p-methylbenzyl)thio]pyrimidine")
| SpectraBase Compound ID | rf26JDvb0y |
|---|---|
| InChI | InChI=1S/C21H17ClN2S2/c1-13-3-5-15(6-4-13)12-25-21-23-10-9-18(24-21)20-14(2)17-11-16(22)7-8-19(17)26-20/h3-11H,12H2,1-2H3 |
| InChIKey | FEMGWTCOGXJGFM-UHFFFAOYSA-N |
| Mol Weight | 396.95 g/mol |
| Molecular Formula | C21H17ClN2S2 |
| Exact Mass | 396.052169 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B38PfYPhuZz |
|---|---|
| Name | 4-(5-chloro-3-methylbenzo[b]thien-2-yl)-2-[(p-methylbenzyl)thio]pyrimidine |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H17ClN2S2 |
| InChI | InChI=1S/C21H17ClN2S2/c1-13-3-5-15(6-4-13)12-25-21-23-10-9-18(24-21)20-14(2)17-11-16(22)7-8-19(17)26-20/h3-11H,12H2,1-2H3 |
| InChIKey | FEMGWTCOGXJGFM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58410M |
| Solvent | CDCl3 |