HRID1121082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Cc1cn(CC2CC(c3cc[c]([Sn]([CH3])([CH3])[CH3])cc3)=NO2)nn1

HCID59749474

未命名化合物

结构：CC(C)(C)[Si](C)(C)OCC1CN(c2ccc(I)c(F)c2)C(=O)O1

HCID60007162

未命名化合物

PRODUCTS

生成物

结构：Cc1cn(CC2CC(c3ccc(-c4ccc(N5CC(CO[Si](C)(C)C(C)(C)C)OC5=O)cc4F)cc3)=NO2)nn1

HCID72374234

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1cb9f3e40c994cf19bef49aa936da577
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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