HRID102565

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53257826

未命名化合物

HCID178478394

3-Bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine

C5H2BrClN4

PRODUCTS

产物

HCID178487401

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1c1bc6d319364d5c9e370d76f1122296
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:32][c:33]1[n:34][nH:35][c:36]2[n:37][cH:38][n:39][c:40]([Cl:42])[c:41]12.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:26]3[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]3)[cH:7][c:8](-[c:13]3[n:14][c:15]([NH:19][CH2:20][CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[n:16][cH:17][cH:18]3)[cH:9][c:10]2[cH:11][cH:12]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:26]3[CH2:27][CH2:28][N:29]([c:40]4[n:39][cH:38][n:37][c:36]5[nH:35][n:34][c:33]([Br:32])[c:41]54)[CH2:30][CH2:31]3)[cH:7][c:8](-[c:13]3[n:14][c:15]([NH:19][CH2:20][CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[n:16][cH:17][cH:18]3)[cH:9][c:10]2[cH:11][cH:12]1