HRID2159703

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID76652

Phenylalaninol

C9H13NO

结构：CC(=O)N1CCN(c2cc(C)c3nc(-c4c(Cl)cc[nH]c4=O)[nH]c3c2)CC1

HCID135681697

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CCN(c2cc(C)c3nc(-c4c(NC(CO)Cc5ccccc5)cc[nH]c4=O)[nH]c3c2)CC1

HCID135553284

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fa6df83c81064253897da7c1e050d317
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][c:12]([CH3:27])[c:13]3[c:14]([nH:15][c:16](-[c:18]4[c:19](=[O:25])[nH:20][cH:21][cH:22][c:23]4[Cl:24])[n:17]3)[cH:26]2)[CH2:8][CH2:9]1.[CH3:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[NH2:28][CH:29]([CH2:30][OH:31])[CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[O:46]=[CH:47][N:48]([CH3:49])[CH3:50]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][c:12]([CH3:27])[c:13]3[c:14]([nH:15][c:16](-[c:18]4[c:19](=[O:25])[nH:20][cH:21][cH:22][c:23]4[NH:28][CH:29]([CH2:30][OH:31])[CH2:32][c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[n:17]3)[cH:26]2)[CH2:8][CH2:9]1