HRID1208433

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID254951

2-(2-Chloroethoxy)tetrahydro-2H-pyran

C7H13ClO2

HCID453245

5H-Pyrido(2,3-b)(1,5)benzodiazepin-5-one, 6,11-dihydro-6-methyl-

C13H11N3O

结构：CN1C(=O)c2cccnc2N(CCOC2CCCCO2)c2ccccc21

HCID23372608

未命名化合物

PRODUCTS

生成物

HCID453261

N11-(2-Hydroxyethyl)-N6-methyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one

C15H15N3O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-300bc93572334b14a76a460e4be3de90
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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