HRID1217013

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID68471263

未命名化合物

结构：NC(Cc1cc(F)cc(F)c1)C(O)CNC1(c2cccc(C(F)(F)F)c2)CC1

HCID77242545

未命名化合物

HCID178418300

未命名化合物

PRODUCTS

生成物

结构：CCOCCN1CCc2c(C(=O)NC(Cc3cc(F)cc(F)c3)C(O)CNC3(c4cccc(C(F)(F)F)c4)CC3)cccc2C1=O

HCID74428710

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-21f06ab3beaa49b884f37e7828588b6f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:30]([CH3:31])[O:32][CH2:33][CH2:34][N:35]1[C:36](=[O:48])[c:37]2[cH:38][cH:39][cH:40][c:41]([C:45](=[O:46])[OH:47])[c:42]2[CH2:43][CH2:44]1.[CH3:60][N:61]([CH3:62])[CH2:63][CH2:64][CH2:65][N:66]=[C:67]=[N:68][CH2:69][CH3:70].[CH:71]([N:72]([CH2:73][CH3:74])[CH:75]([CH3:76])[CH3:77])([CH3:78])[CH3:79].[Cl:80][CH2:81][Cl:82].[ClH:1].[ClH:59].[NH2:2][CH:3]([CH:4]([CH2:5][NH:6][C:7]1([c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1)[OH:20])[CH2:21][c:22]1[cH:23][c:24]([F:29])[cH:25][c:26]([F:28])[cH:27]1.[OH:49][c:50]1[c:51]2[n:52][n:53][nH:54][c:55]2[cH:56][cH:57][cH:58]1>>[NH:2]([CH:3]([CH:4]([CH2:5][NH:6][C:7]1([c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1)[OH:20])[CH2:21][c:22]1[cH:23][c:24]([F:29])[cH:25][c:26]([F:28])[cH:27]1)[C:45]([c:41]1[cH:40][cH:39][cH:38][c:37]2[c:42]1[CH2:43][CH2:44][N:35]([CH2:34][CH2:33][O:32][CH2:30][CH3:31])[C:36]2=[O:48])=[O:46]