HRID195918

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：COc1cc(CC(=O)N2CCC(Nc3cccc(F)c3)CC2)ccc1CN1CCN(C(=O)OC(C)(C)C)C(C)C1

HCID178491575

未命名化合物

PRODUCTS

生成物

结构：COc1cc(CC(=O)N2CCC(Nc3cccc(F)c3)CC2)ccc1CN1CCNC(C)C1

HCID178491574

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff0e290b767a484dac80c81b66e2446f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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