HRID1204082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID12664594

未命名化合物

结构：CC(C)(C)[Si](C)(C)OC1CN(C(=O)c2cc3nccc(Oc4ccc(N)cc4F)c3s2)C1

HCID58790300

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1NC(=O)CC(=O)Nc1ccc(Oc2ccnc3cc(C(=O)N4CC(O[Si](C)(C)C(C)(C)C)C4)sc23)c(F)c1

HCID58790105

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2ee0f4c24a254048acf25276dc0a59d5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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