HRID1136952

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID13375154

3-Amino-2,3-dihydro-1,5-benzoxazepin-4(5H)-one

C9H10N2O2

HCID21072494

未命名化合物

PRODUCTS

生成物

结构：CC(C(=O)NCC(F)(F)C(F)(F)F)C(=O)NC1COc2ccccc2NC1=O

HCID73741640

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f21bd86d1d134ee9abb2d4551ede62bb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:14][CH:15]([C:16](=[O:17])[OH:18])[C:19](=[O:20])[NH:21][CH2:22][C:23]([C:24]([F:25])([F:26])[F:27])([F:28])[F:29].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[NH2:1][CH:2]1[CH2:3][O:4][c:5]2[c:6]([cH:10][cH:11][cH:12][cH:13]2)[NH:7][C:8]1=[O:9].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH2:30].[OH:31][n:32]1[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[NH:1]([CH:2]1[CH2:3][O:4][c:5]2[c:6]([cH:10][cH:11][cH:12][cH:13]2)[NH:7][C:8]1=[O:9])[C:16]([CH:15]([CH3:14])[C:19](=[O:20])[NH:21][CH2:22][C:23]([C:24]([F:25])([F:26])[F:27])([F:28])[F:29])=[O:17]