HRID1570587

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID103968

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

C16H15F2I

HCID21295713

未命名化合物

PRODUCTS

生成物

结构：COCC1CN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CCN1C(=O)C(F)(F)F

HCID21295681

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-01efa4b301f944b584081af1b86a4abe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:16][N:17]([CH3:18])[CH:19]=[O:20].[CH3:1][O:2][CH2:3][CH:4]1[N:5]([C:10]([C:11]([F:12])([F:13])[F:14])=[O:15])[CH2:6][CH2:7][NH:8][CH2:9]1.[I:21][CH2:22][CH2:23][CH2:24][CH:25]([c:26]1[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]1)[c:33]1[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]1.[OH2:40]>>[CH3:1][O:2][CH2:3][CH:4]1[N:5]([C:10]([C:11]([F:12])([F:13])[F:14])=[O:15])[CH2:6][CH2:7][N:8]([CH2:22][CH2:23][CH2:24][CH:25]([c:26]2[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]2)[c:33]2[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]2)[CH2:9]1