HRID319419

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID11040979

1-methyl-1H-indole-7-carbaldehyde

C10H9NO

HCID67027548

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)CCCNc1nc(NC2CCN(Cc3cccc4ccn(C)c34)CC2)c2ccccc2n1

HCID58006186

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-963a450b676e4eba9cdac8844685ef66
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

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