HRID141590

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID97268

Di-tert-butyl azodicarboxylate

C10H18N2O4

HCID209342

1-Pyrrolidinepropanol

C7H15NO

结构：Nc1ncc(-c2ccc(O)cc2)cc1-c1nc2cccnc2o1

HCID67389007

未命名化合物

PRODUCTS

生成物

结构：Nc1ncc(-c2ccc(OCCCN3CCCC3)cc2)cc1-c1nc2cccnc2o1

HCID67388515

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aa104aedcc6d4c57bbed0d64de89bcfe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Cl:68][CH2:69][Cl:70].[N:1]([C:2]([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])=[O:8])=[N:9][C:10]([O:11][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16].[N:59]1([CH2:64][CH2:65][CH2:66][OH:67])[CH2:60][CH2:61][CH2:62][CH2:63]1.[NH2:17][c:18]1[c:19](-[c:31]2[o:32][c:33]3[n:34][cH:35][cH:36][cH:37][c:38]3[n:39]2)[cH:20][c:21](-[c:24]2[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]2)[cH:22][n:23]1.[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[NH2:17][c:18]1[c:19](-[c:31]2[o:32][c:33]3[n:34][cH:35][cH:36][cH:37][c:38]3[n:39]2)[cH:20][c:21](-[c:24]2[cH:25][cH:26][c:27]([O:30][CH2:66][CH2:65][CH2:64][N:59]3[CH2:60][CH2:61][CH2:62][CH2:63]3)[cH:28][cH:29]2)[cH:22][n:23]1