HRID1212617

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2758519

3-(Dimethylamino)pyrrolidine

C6H14N2

结构：CC1Cc2ccc(-c3cc(C(=O)O)n(C)c3)cc2CN1c1cc(N2CCN(C)CC2)nc(N)n1

HCID59402268

未命名化合物

PRODUCTS

生成物

结构：CC1Cc2ccc(-c3cc(C(=O)N4CCC(N(C)C)C4)n(C)c3)cc2CN1c1cc(N2CCN(C)CC2)nc(N)n1

HCID46700980

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8383395b281c410da443734800a12bbc
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

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