HRID122555

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID615038

1-(4-Fluoro-benzenesulfonyl)-pyrrolidine-2-carboxylic acid

C11H12FNO4S

HCID66832336

未命名化合物

PRODUCTS

生成物

结构：O=C(NCc1nccc(-c2ccc(C(F)(F)F)cc2)n1)C1CCCN1S(=O)(=O)c1ccc(F)cc1

HCID178523095

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d281cf66c1c1422bb33212b56aca69e6
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

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