Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1770938생성일: 2026년 10월 26일
2-Oxopropanethioamide → 6'-Bromo-4-methoxy-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazole]-4''(3''H)-thione
https://huagongshe.com/reaction/1770938
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | 2-Oxopropanethioamide | HCID 20765237 | — |
| 반응물 | Trans-6'-bromo-4-methoxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-imine | HCID 67979447 | — |
| 용매 | Methanol | HCID 887 | — |
| 생성물 | 6'-Bromo-4-methoxy-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazole]-4''(3''H)-thione | HCID 86667271 | 64.5% |
반응 단계
6′-Bromo-4-methoxyspiro[cyclohexane-1,2′-inden]-1′(3′H)-imine (Example 19 Step 2, 1.41 g, 4.57 mmol) and 2-oxopropanethioamide (Intermediate 2, 1.42 g, 13.7 mmol) were dissolved in dry MeOH (30 mL) and the resulting solution was heated at 60° C. under an atmosphere of nitrogen. After 15 h the reaction was allowed to cool to r.t. A precipitate had formed which was filtered off and dried in vacuo, yielding the title compound (1.16 g, 64% yield) as a mixture of isomers. 1H NMR (500 MHz, DMSO-d6) δ ppm 1.18 (m, 4H), 1.47 (m, 2H), 1.87 (m, 2H), 2.27 (m, 3H), 3.03 (m, 3H), 3.20 (s, 3H), 6.98 (d, 1H), 7.34 (d, 1H), 7.51 (dd, 1H); MS (APCI+) m/z 394 [M+H]+.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US09248129B2 |
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| 출처 데이터셋 | uspto-grants-2016_02 |
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| ORD ID | ord-f235d13388f34623bbe0517029c2ce6a |
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| 출처 메모 | uspto-grants-2016_02 |
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