HRID138798

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID258544

6-(Dimethylamino)hexylamine

C8H20N2

结构：O=Cc1ccc(-c2cc3nccc(Nc4ccc5[nH]ccc5c4)c3s2)cc1

HCID18382743

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCCCCCNCc1ccc(-c2cc3nccc(Nc4ccc5[nH]ccc5c4)c3s2)cc1

HCID18382923

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-353bd111ec6e48a196ee88e4d696fb62
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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