HRID2342642

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID15079229

1-(Quinolin-8-yl)methanamine

C10H10N2

HCID18440314

未命名化合物

PRODUCTS

生成物

结构：O=C1NC(=O)C2(CCc3cc(C(=O)NCc4cccc5cccnc45)ccc3C2)N1

HCID9843928

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-375cd8cec0014a55b2885be6fe8249f0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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