HRID189032

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

HCID76804

4-(Trifluoromethyl)benzylamine

C8H8F3N

HCID10913462

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccc(OC)c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1)OCC

HCID10906522

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae1adc623d2a469f9a9574e61ad28040
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

[C:34]([P:35](=[O:36])([O:37][CH2:38][CH3:39])[O:40][CH2:41][CH3:42])#[N:43].[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:16][CH3:17])[c:11]([C:12](=[O:13])[OH:14])[cH:15]1)[O:18][CH2:19][CH3:20])=[O:21].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[F:22][C:23]([c:24]1[cH:25][cH:26][c:27]([CH2:28][NH2:29])[cH:30][cH:31]1)([F:32])[F:33].[OH2:56]>>[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:16][CH3:17])[c:11]([C:12](=[O:14])[NH:29][CH2:28][c:27]2[cH:26][cH:25][c:24]([C:23]([F:22])([F:32])[F:33])[cH:31][cH:30]2)[cH:15]1)[O:18][CH2:19][CH3:20])=[O:21]