HRID141246

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6811

Phthalic anhydride

C8H4O3

HCID7914

Isopropyl ether

C6H14O

HCID8028

Tetrahydrofuran

C4H8O

结构：CCOc1c(CN2CCCCC2)c2c(c3c1OC(C)(C)C3)C(c1cccc(N)c1)=NC(C)(C)C2

HCID22343774

未命名化合物

PRODUCTS

生成物

结构：CCOc1c(CN2CCCCC2)c2c(c3c1OC(C)(C)C3)C(c1cccc(NC(=O)c3ccccc3C(=O)O)c1)=NC(C)(C)C2

HCID22344044

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c80a60a0e0c42dc9572d56de4c8344e
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

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