HRID1563216

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID57991898

未命名化合物

结构：CC(C)(C)[Si](C)(C)Oc1cccc(C(CN)O[Si](C)(C)C(C)(C)C)c1

HCID57991914

未命名化合物

HCID67089431

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)Oc1cccc(C(CNc2nnc(-c3ccc4cnccc4c3)s2)O[Si](C)(C)C(C)(C)C)c1

HCID67089325

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2bd1a60ca8d240d1b6489bee4d0012fb
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][NH2:9])[c:10]1[cH:11][c:12]([O:16][Si:17]([CH3:18])([CH3:19])[C:20]([CH3:21])([CH3:22])[CH3:23])[cH:13][cH:14][cH:15]1)([CH3:24])[CH3:25].[CH3:26][S:27](=[O:28])(=[O:29])[c:30]1[n:31][n:32][c:33](-[c:35]2[cH:36][c:37]3[cH:38][cH:39][n:40][cH:41][c:42]3[cH:43][cH:44]2)[s:34]1.[CH3:45][S:46]([c:47]1[s:48][c:49](-[c:50]2[cH:51][c:52]3[c:53]([cH:54][cH:55]2)[cH:56][n:57][cH:58][cH:59]3)[n:60][n:61]1)=[O:62]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][NH:9][c:30]1[n:31][n:32][c:33](-[c:35]2[cH:36][c:37]3[cH:38][cH:39][n:40][cH:41][c:42]3[cH:43][cH:44]2)[s:34]1)[c:10]1[cH:11][c:12]([O:16][Si:17]([CH3:18])([CH3:19])[C:20]([CH3:21])([CH3:22])[CH3:23])[cH:13][cH:14][cH:15]1)([CH3:24])[CH3:25]