HRID300442

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7498

alpha-Bromotoluene

C7H7Br

反应SMILES：CNS(=O)(=O)c1ccc(-c2ncnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nc4-c4ccc(F)cc4)cc23)s1

HCID23537543

未命名化合物

PRODUCTS

产物

反应SMILES：CN(Cc1ccccc1)S(=O)(=O)c1ccc(-c2ncnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nc4-c4ccc(F)cc4)cc23)s1

HCID69589565

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9d91ead86eb84752a29b2a85910c7d29
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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