HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Cyanobenzoic acid → HCID 67326054, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 3-Cyanobenzoic acid | HCID 15875 | — |
| Reactant | (4-(4-phenylthiazol-2-yl)tetrahydro-2H-pyran-4-yl)methanamine | HCID 67322930 | — |
| Product | HCID 67326054 | HCID 67326054 | 89% |
Reaction Steps
This compound was synthesized from (4-(4-phenylthiazol-2-yl)tetrahydro-2H-pyran-4-yl)methanamine and 3-cyanobenzoic acid as described in example 8 step 6 (6.6 g, yield 89%) as a white solid. 1H NMR (300 MHz, CDCl3) δ 8.11-8.10 (m, 1H), 8.02-7.99 (dt, J=7.9 Hz, 1.5 Hz, 1H), 7.91-7.88 (m, 2H), 7.78-7.74 (dt, J=7.7 Hz, 1.3 Hz, 1H), 7.71-7.68 (m, 1H), 7.53-7.46 (m, 3H), 7.42-7.36 (m, 1H), 3.97-3.90 (m, 2H), 3.85-3.83 (d, J=5.7 Hz, 2H), 3.77-3.69 (m, 2H), 2.35-2.29 (m, 2H), 2.07-1.98 (m, 2H). MS (ESI) m/z: Calculated for C23H21N3O2S: 403.14. found: 402.2 (M−H)−.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08901156B2 |
| Source dataset | uspto-grants-2014_12 |
| ORD ID | ord-936ec704acbb4522847b13ea9b6dfb7c |
| Source note | uspto-grants-2014_12 |