HRID317939

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1031

1-Propanol

C3H8O

HCID8471

Triethylamine

C6H15N

HCID73247

3(2H)-Pyridazinone, 4,5-dichloro-

C4H2Cl2N2O

HCID19689424

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CNc2cn[nH]c(=O)c2Cl)cc1OCCCN1CCN(C=O)CC1

HCID15859188

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0d9fce184ea4991b01bc2e72189f3a9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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