HRID2125088

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

结构：CCN(CC1CCCO1)c1nc(Nc2ccc(-n3ccnc3C)cc2)nc2c1CN(C(=O)OC(C)(C)C)CC2

HCID59333772

未命名化合物

PRODUCTS

生成物

结构：CCN(CC1CCCO1)c1nc(Nc2ccc(-n3ccnc3C)cc2)nc2c1CNCC2

HCID59333811

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-958d291aed874bdea715f3064c9d87c9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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