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【结 构 式】 
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【分子编号】28965 【品名】2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 【CA登记号】 |
【 分 子 式 】C9H12N2OS 【 分 子 量 】196.27316 【元素组成】C 55.08% H 6.16% N 14.27% O 8.15% S 16.34% |
与该中间体有关的原料药合成路线共 1 条
合成路线1
该中间体在本合成路线中的序号：(IV)LM-1554 is synthesized by condensation of 2-amino-3-carbethoxy-4,5,6,7-tetrahydrobenzo[b]thiophene (I) with chloroacetonitrile (III) in the presence of dry hydrogen chloride gas followed by basification. Alternatively, 2-amino-3-carbamoyl-4,5,6,7-tetrahydrobenzo[b]thiophene (IV) can be condensed with chloroacetonitrile (III) under the above reaction conditions. The condensation of (I) with chloroacetamide (II) in the presence of an equivalent of phosphorus oxychloride in chloroform followed by basification also yields LM-1554.
| 【1】 Shishoo, C.J.; et al.; Process for the manufacture of pharmacologically active new heterocyclic compounds and salts thereof. IN 151496 . |
| 【2】 Arya, V.P.; LM-1554. Drugs Fut 1985, 10, 2, 123. |
| 中间体序号 | 中间体编号 | 品名 | CAS号 | 分子式 | 供应商 | 用于合成 |
|---|---|---|---|---|---|---|
| (I) | 28963 | ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | 4506-71-2 | C11H15NO2S | 详情 | 详情 |
| (II) | 28964 | 2-chloroacetamide | 79-07-2 | C2H4ClNO | 详情 | 详情 |
| (III) | 14443 | 2-chloroacetonitrile; chloroacetonitrile | 107-14-2 | C2H2ClN | 详情 | 详情 |
| (IV) | 28965 | 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide | C9H12N2OS | 详情 | 详情 |
Extended Information