HRID182705

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5287830

Purine, 6-bromo-

C5H3BrN4

HCID6101139

2-Amino-6-bromopurine

C5H4BrN5

结构：Cc1cccc2nc(C(C)Nc3ncnc4[nH]cc(Br)c34)n(-c3cccc(F)c3)c(=O)c12

HCID11598408

未命名化合物

结构：CC(Nc1ncnc2[nH]cnc12)c1nc2ccccc2c(=O)n1-c1cc(F)cc(F)c1

HCID178463554

未命名化合物

PRODUCTS

生成物

结构：CC(Nc1nc(N)nc2[nH]cnc12)c1nc2ccccc2c(=O)n1-c1cc(F)cc(F)c1

HCID178463608

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7d8331cbc1741fcbc6fa51122302586
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:43][c:44]1[n:45][cH:46][n:47][c:48]2[c:49]1[nH:50][cH:51][n:52]2.[Br:53][c:54]1[c:55]2[c:56]([NH:57][CH:58]([c:59]3[n:60](-[c:61]4[cH:62][cH:63][cH:64][c:65]([F:66])[cH:67]4)[c:68](=[O:69])[c:70]4[c:71]([cH:72][cH:73][cH:74][c:75]4[CH3:76])[n:77]3)[CH3:78])[n:79][cH:80][n:81][c:82]2[nH:83][cH:84]1.[F:1][c:2]1[cH:3][c:4](-[n:9]2[c:10]([CH:20]([CH3:21])[NH:22][c:23]3[c:24]4[n:25][cH:26][nH:27][c:28]4[n:29][cH:30][n:31]3)[n:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[c:18]2=[O:19])[cH:5][c:6]([F:8])[cH:7]1.[NH2:32][c:33]1[n:34][c:35]2[c:36]([nH:37][cH:38][n:39]2)[c:40]([Br:41])[n:42]1>>[F:1][c:2]1[cH:3][c:4](-[n:9]2[c:10]([CH:20]([CH3:21])[NH:22][c:23]3[c:24]4[n:25][cH:26][nH:27][c:28]4[n:29][c:30]([NH2:32])[n:31]3)[n:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[c:18]2=[O:19])[cH:5][c:6]([F:8])[cH:7]1