HRID943908

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6342

Acetonitrile

C2H3N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID58879972

未命名化合物

HCID86611726

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1cccn(-c2ccc(F)cc2)c1=O)c1ccc(Nc2cc(Cl)nn3ccnc23)cc1

HCID86611725

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-927db9ee756847bb963014d971dcc0dc
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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