HRID949181

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID3899172

6-pyrrolidin-1-ylpyridin-3-amine

C9H13N3

HCID66850442

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc(N2CCCC2)nc1)c1cc2cc(I)ccc2n1Cc1cccc(F)c1

HCID66850279

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a18d309ac48b4a1aa0c129bd06f3f045
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

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