HRID168056

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID2756485

tert-Butyl 3-(aminomethyl)pyrrolidine-1-carboxylate

C10H20N2O2

结构：Cc1c(Cl)nc(Cl)c(=O)n1CC(=O)OCc1ccccc1

HCID10663926

未命名化合物

PRODUCTS

生成物

结构：Cc1c(Cl)nc(NCC2CCN(C(=O)OC(C)(C)C)C2)c(=O)n1CC(=O)OCc1ccccc1

HCID178427964

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5bea7b4ad1834d08b326c5db6b2642ef
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

[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl:1][c:2]1[c:3]([CH3:21])[n:4]([CH2:10][C:11](=[O:12])[O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:5](=[O:9])[c:6]([Cl:8])[n:7]1.[NH2:22][CH2:23][CH:24]1[CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]1>>[Cl:1][c:2]1[c:3]([CH3:21])[n:4]([CH2:10][C:11](=[O:12])[O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:5](=[O:9])[c:6]([NH:22][CH2:23][CH:24]2[CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]2)[n:7]1