HRID1114109

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID7096

Phenylpiperazine

C10H14N2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID18766

1,12-Dibromododecane

C12H24Br2

PRODUCTS

生成物

HCID19937754

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ee3ed6132ef24db1814878b75561432f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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