HRID1546641

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID21091408

未命名化合物

HCID68975627

未命名化合物

PRODUCTS

生成物

结构：CC(O)(C(=O)NCC(F)(F)C(F)(F)F)C(=O)NC1CN(CCOCc2ccccc2)c2ccccc2NC1=O

HCID74412495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f01f2143d1b47fca02fea6850654d6d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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