HRID89565

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4067207

3-Methoxybenzyl bromide

C8H9BrO

结构：Cc1nc(OCC(=O)N(C)C2CCNCC2)nc(C)c1NC(=O)OC(C)(C)C

HCID59336171

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(CN2CCC(N(C)C(=O)COc3nc(C)c(NC(=O)OC(C)(C)C)c(C)n3)CC2)c1

HCID59336172

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d77c4a3b72c84828907a444f398744c3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:29][CH2:30][c:31]1[cH:32][c:33]([O:37][CH3:38])[cH:34][cH:35][cH:36]1.[CH3:1][c:2]1[n:3][c:4]([O:17][CH2:18][C:19](=[O:20])[N:21]([CH:22]2[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]2)[CH3:28])[n:5][c:6]([CH3:16])[c:7]1[NH:8][C:9]([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15]>>[CH3:1][c:2]1[n:3][c:4]([O:17][CH2:18][C:19](=[O:20])[N:21]([CH:22]2[CH2:23][CH2:24][N:25]([CH2:30][c:31]3[cH:32][c:33]([O:37][CH3:38])[cH:34][cH:35][cH:36]3)[CH2:26][CH2:27]2)[CH3:28])[n:5][c:6]([CH3:16])[c:7]1[NH:8][C:9]([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15]