HRID186567

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

HCID59674145

未命名化合物

结构：CN(c1ccc2c(c1)nc(NCc1ccccc1)n2C)c1ccnc(Cl)n1

HCID59674170

未命名化合物

PRODUCTS

生成物

结构：CONS(=O)(=O)c1cc(Nc2nccc(N(C)c3ccc4c(c3)nc(NCc3ccccc3)n4C)n2)ccc1C

HCID10311954

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d367978bd034c4bbd93828149e3f4b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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