HRID2328742

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID103968

1,1'-(4-Iodobutane-1,1-diyl)bis(4-fluorobenzene)

C16H15F2I

HCID14230241

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(Cl)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)C(CO)C1

HCID14230164

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-76fcd993b8e44887b343a4d1dfa26278
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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