HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 33303Generated: October 29, 2026
Lawesson's reagent → 2-Phenyl-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indole-6-thione
https://huagongshe.com/reaction/33303
Participants
| Role | Name | HCID | Charge |
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| Reactant | Lawesson's reagent | HCID 87949 | — |
| Reactant | 2-Phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one | HCID 10220882 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | 2-Phenyl-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indole-6-thione | HCID 11832752 | 68.7% |
Reaction Steps
Compound 12 (48.6 mg, 0.18 mmol) in toluene (2 mL) was treated with Lawesson's reagent (75 mg, 0.18 mmol) at room temperature. The solution was heated at reflux for 2 h, then allowed to cool to room temperature and diluted with water. The mixture was extracted with EtOAc (3×5 mL). The organic solution was washed with water and brine, dried (Na2SO4), filtered, and concentrated. The crude product was crystallized (CH2Cl2/hexanes) to give the thioamide 34.4 mg (68%) as a yellow solid. mp 223-226° C. (dec.); 1H NMR (300 MHz, d6-DMSO) δ 3.10 (m, 2H), 3.50 (m, 2H), 7.23 (app t, 1H, J=7.8 Hz), 7.57 (m, 1H), 7.61 (m, 3H), 7.69 (m, 2H), 8.19 (d, 1H, J=7.6 Hz), 10.56 (br t, 1H), 11.68 (br s, 1H); HRMS (FAB, MH+) Calcd for C17H15N2S: 279.0956, Found: 279.0952; Anal. (C17H14N2S.0.25 H2O) C, H, N, S.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07429578B2 |
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| Source dataset | uspto-grants-2008_09 |
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| ORD ID | ord-271cba7b619d4235bcc091d413e25b7f |
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| Source note | uspto-grants-2008_09 |
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