HRID125791

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID18066

1-Aminotetralin

C10H13N

HCID82129

Carbonochloridic acid, 4-nitrophenyl ester

C7H4ClNO4

HCID738389

7-chloro-4-(piperazin-1-yl)quinoline

C13H14ClN3

PRODUCTS

生成物

结构：O=C(NC1CCCc2ccccc21)N1CCN(c2ccnc3cc(Cl)ccc23)CC1

HCID21101751

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc09eadb34d849ff8fd8c99e3ea96ddf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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