HRID1212318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID10906

tert-Butyl nitrite

C4H9NO2

HCID549976

1-Hydroxy-2,2,6,6-tetramethylpiperidine

C9H19NO

结构：CC(C)(C)CC(C)(C)c1cc(-n2nc3ccc(-c4ccc(N)cc4)cc3n2)c(O)c(C(C)(C)c2ccccc2)c1

HCID22595033

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)CC(C)(C)c1cc(-n2nc3ccc(-c4ccc(ON5C(C)(C)CCCC5(C)C)cc4)cc3n2)c(O)c(C(C)(C)c2ccccc2)c1

HCID10146488

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab0adb7414e644d7bebd2879273ea40b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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