HRID1211226

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID21896883

未命名化合物

HCID21896901

未命名化合物

结构：CCOc1cc(OC)ccc1C1=NC(CC2CCCC2)C(c2ccc(Cl)cc2)N1

HCID178467016

5-(4-chloro-phenyl)-4-cyclopentylmethyl-2-(2-ethoxy-4-methoxy-phenyl)-4,5-dihydro-1H-imidazole

C24H29ClN2O2

PRODUCTS

生成物

结构：CCCCCC1N=C(c2ccc(OC)cc2OCC)NC1c1ccc(Cl)cc1

HCID178442280

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ebd82724d3584623b5b4c33abfc9eb0a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:18]([O:19][c:20]1[cH:21][c:22]([O:23][CH3:24])[cH:25][cH:26][c:27]1[C:28](=[NH:29])[O:30][CH2:31][CH3:32])[CH3:33].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]([NH2:7])[CH:8]([NH2:9])[CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[cH:15][cH:16]1.[Cl:34][c:35]1[cH:36][cH:37][c:38]([CH:41]2[CH:42]([CH2:57][CH:58]3[CH2:59][CH2:60][CH2:61][CH2:62]3)[N:43]=[C:44]([c:46]3[c:47]([O:54][CH2:55][CH3:56])[cH:48][c:49]([O:52][CH3:53])[cH:50][cH:51]3)[NH:45]2)[cH:39][cH:40]1.[ClH:17]>>[Cl:34][c:35]1[cH:36][cH:37][c:38]([CH:41]2[CH:42]([CH2:57][CH2:58][CH2:59][CH2:60][CH3:61])[N:43]=[C:44]([c:46]3[c:47]([O:54][CH2:55][CH3:56])[cH:48][c:49]([O:52][CH3:53])[cH:50][cH:51]3)[NH:45]2)[cH:39][cH:40]1