HRID92801

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID77575

2,2-Diphenylethylamine

C14H15N

结构：O=C(O)c1cccc(-c2cnc3c(c2)N(Cc2cc(Cl)ccc2C(F)(F)F)CCN3)c1

HCID58327807

未命名化合物

PRODUCTS

生成物

结构：O=C(NCC(c1ccccc1)c1ccccc1)c1cccc(-c2cnc3c(c2)N(Cc2cc(Cl)ccc2C(F)(F)F)CCN3)c1

HCID67091428

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c83e1a22971b404bad4585c1090f3511
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

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