HRID198587

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID2756613

1-benzylpyrrolidin-3-amine

C11H16N2

HCID3028194

Lithium

反应SMILES：O=C(O)Cc1nc2c(C(F)(F)F)cccc2[nH]1

HCID21111780

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(Cc1nc2c(C(F)(F)F)cccc2[nH]1)NC1CCN(Cc2ccccc2)C1

HCID77165654

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ce895915211e4782bc6031260a79484f
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

[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[N:26]1[CH2:27][CH:28]([NH2:31])[CH2:29][CH2:30]1.[CH3:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH2:48][CH2:49][N:50]([CH3:51])[CH3:52].[CH:53]([N:54]([CH:55]([CH3:56])[CH3:57])[CH2:58][CH3:59])([CH3:60])[CH3:61].[Cl:72][CH2:73][Cl:74].[F:2][C:3]([c:4]1[cH:5][cH:6][cH:7][c:8]2[nH:9][c:10]([CH2:13][C:14](=[O:15])[OH:16])[n:11][c:12]12)([F:17])[F:18].[Li:1].[Na+:66].[O-:62][C:63]([OH:64])=[O:65].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1>>[F:2][C:3]([c:4]1[cH:5][cH:6][cH:7][c:8]2[nH:9][c:10]([CH2:13][C:14](=[O:16])[NH:31][CH:28]3[CH2:27][N:26]([CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:30][CH2:29]3)[n:11][c:12]12)([F:17])[F:18]