HRID111371

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2776438

2-Phenyl-5-(trifluoromethyl)oxazole-4-carboxylic acid

C11H6F3NO3

HCID3015333

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc(NCCO)nc1)c1nc(-c2ccccc2)oc1C(F)(F)F

HCID59301302

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5bc9ca5a3fdd41ca820348dfd5b65de0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:41]([N:42]=[C:43]=[N:44][CH2:45][CH2:46][CH2:47][N:48]([CH3:49])[CH3:50])[CH3:51].[CH2:52]([Cl:53])[Cl:54].[ClH:40].[NH2:19][c:20]1[cH:21][cH:22][c:23]([NH:26][CH2:27][CH2:28][OH:29])[n:24][cH:25]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH:30][n:31]1[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1.[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:13])[OH:14])[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:14])[NH:19][c:20]3[cH:21][cH:22][c:23]([NH:26][CH2:27][CH2:28][OH:29])[n:24][cH:25]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1