HRID1567762

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID821864

3-bromo-2-methylbenzo[b]thiophene

C9H7BrS

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1nc(N2CCOCC2)c2sc(CN3CCC(N(C)C)CC3)cc2n1

HCID59605498

未命名化合物

PRODUCTS

生成物

结构：Cc1sc2ccccc2c1-c1nc(N2CCOCC2)c2sc(CN3CCC(N(C)C)CC3)cc2n1

HCID49832939

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ba5cf1cf20e4166a1be3eba37abf816
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:39][c:40]1[c:41]2[c:42]([s:43][c:44]1[CH3:45])[cH:46][cH:47][cH:48][cH:49]2.[CH3:1][N:2]([CH:3]1[CH2:4][CH2:5][N:6]([CH2:9][c:10]2[cH:11][c:12]3[n:13][c:14]([Sn:25]([CH2:26][CH2:27][CH2:28][CH3:29])([CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH2:36][CH3:37])[n:15][c:16]([N:19]4[CH2:20][CH2:21][O:22][CH2:23][CH2:24]4)[c:17]3[s:18]2)[CH2:7][CH2:8]1)[CH3:38]>>[CH3:1][N:2]([CH:3]1[CH2:4][CH2:5][N:6]([CH2:9][c:10]2[cH:11][c:12]3[n:13][c:14](-[c:40]4[c:41]5[c:42]([s:43][c:44]4[CH3:45])[cH:46][cH:47][cH:48][cH:49]5)[n:15][c:16]([N:19]4[CH2:20][CH2:21][O:22][CH2:23][CH2:24]4)[c:17]3[s:18]2)[CH2:7][CH2:8]1)[CH3:38]