HRID1214113

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7918

Acetic anhydride

C4H6O3

结构：Nc1ccc(C(=O)N(CCN2CCC(C(=O)c3ccc(F)cc3)CC2)c2cccnc2)cc1

HCID19690071

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1ccc(C(=O)N(CCN2CCC(C(=O)c3ccc(F)cc3)CC2)c2cccnc2)cc1

HCID19689992

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74aee5230619496c8ccc4ddf931f8abb
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

[CH3:34][C:35](=[O:36])[O:37][C:38](=[O:39])[CH3:40].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]([c:9]2[cH:10][n:11][cH:12][cH:13][cH:14]2)[CH2:15][CH2:16][N:17]2[CH2:18][CH2:19][CH:20]([C:23]([c:24]3[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]3)=[O:31])[CH2:21][CH2:22]2)[cH:32][cH:33]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]([c:9]2[cH:10][n:11][cH:12][cH:13][cH:14]2)[CH2:15][CH2:16][N:17]2[CH2:18][CH2:19][CH:20]([C:23]([c:24]3[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]3)=[O:31])[CH2:21][CH2:22]2)[cH:32][cH:33]1)[C:35]([CH3:34])=[O:36]