HRID88178

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31374

Dimethylacetamide

C4H9NO

HCID152842

Bis(2-oxo-3-oxazolidinyl)phosphinic chloride

C6H8ClN2O5P

HCID2736229

1-(2-dimethylaminoethyl)piperazine

C8H19N3

结构：COc1ccccc1-c1n[nH]c2ncc(-c3cc(C)c(N)c(C(=O)O)c3)cc12

HCID178489392

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1-c1n[nH]c2ncc(-c3cc(C)c(N)c(C(=O)N4CCN(CCN(C)C)CC4)c3)cc12

HCID178489391

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b08964e05cc04b4c8d1418981d726d57
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

[C:55]([N:56]([CH3:57])[CH3:58])(=[O:59])[CH3:60].[CH3:44][N:45]([CH2:46][CH2:47][N:48]1[CH2:49][CH2:50][NH:51][CH2:52][CH2:53]1)[CH3:54].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8](-[c:12]2[cH:13][c:14]3[c:15]([n:16][cH:17]2)[nH:18][n:19][c:20]3-[c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]1[CH3:11].[O:29]=[C:30]1[N:31]([P:32]([Cl:33])([N:34]2[CH2:35][CH2:36][O:37][C:38]2=[O:39])=[O:40])[CH2:41][CH2:42][O:43]1>>[NH2:1][c:2]1[c:3]([C:4](=[O:6])[N:51]2[CH2:50][CH2:49][N:48]([CH2:47][CH2:46][N:45]([CH3:44])[CH3:54])[CH2:53][CH2:52]2)[cH:7][c:8](-[c:12]2[cH:13][c:14]3[c:15]([n:16][cH:17]2)[nH:18][n:19][c:20]3-[c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]1[CH3:11]