HRID696266

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID12671358

[4-(2-Aminoethyl)phenyl]methanol

C9H13NO

结构：Cc1ccc(S(=O)(=O)N2C=CNC(=O)C2CC(=O)O)cc1

HCID68679560

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)N2C=CNC(=O)C2CC(=O)NCCc2ccc(CO)cc2)cc1

HCID68678687

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8bdbcd9757024e42856affbeff2d43b4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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