HRID120676

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID18450

2-Chloro-4,6-dimethoxy-1,3,5-triazine

C5H6ClN3O2

结构：O=C(Nc1ccc(Cl)c(C(=O)O)c1)c1cccc(C(F)(F)F)c1

HCID53401172

2-Chloro-5-[3-(trifluoromethyl)benzamido]benzoic acid

C15H9ClF3NO3

HCID59652728

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cccc(Nc2ncc(NC(=O)c3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3Cl)cn2)c1

HCID24961823

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5bb2a1e049714db18511101383a6c513
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

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