HRID835450

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7515

N-Methylaniline

C7H9N

HCID8857

Ethyl acetate

C4H8O2

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

结构：O=C(Nc1ccccc1)Nc1ccc(Oc2cc(Cl)ncn2)cc1

HCID22937019

未命名化合物

PRODUCTS

生成物

结构：CN(c1ccccc1)c1cc(Oc2ccc(NC(=O)Nc3ccccc3)cc2)ncn1

HCID22937000

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c13788489ea84ebda1b752d7ddadc49e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:25][NH:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:40][N:41]1[CH2:42][CH2:43][CH2:44][C:45]1=[O:46].[Cl:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:16](=[O:17])[NH:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[cH:13][cH:14]2)[n:5][cH:6][n:7]1.[OH2:39]>>[c:2]1([N:26]([CH3:25])[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:3][c:4]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:16](=[O:17])[NH:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[cH:13][cH:14]2)[n:5][cH:6][n:7]1