HRID93730

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID122951

4-(Bromomethyl)benzophenone

C14H11BrO

结构：CCOC(=O)C=Cc1ccc(N(C(=O)OC(C)(C)C)C2CCNC2)nc1

HCID178470978

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C=Cc1ccc(N(C(=O)OC(C)(C)C)C2CCN(Cc3ccc(C(=O)c4ccccc4)cc3)C2)nc1

HCID178470988

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2b50598d14ce49829dec633492dcf304
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

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