HRID97383

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8471

Triethylamine

C6H15N

HCID31275

1,4-Dioxane

C4H8O2

HCID120053

11-(Chloroacetyl)-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one

C14H10ClN3O2

HCID417391

N,N-Dimethylpiperidin-4-amine

C7H16N2

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CN(C)C1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc32)CC1

HCID13578579

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1b14b5a9be5e43e88542d3ba06d15cf7
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

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