HRID1240002

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID8857

Ethyl Acetate

C4H8O2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID256208

5-Methylnicotinic acid

C7H7NO2

HCID57786585

未命名化合物

PRODUCTS

产物

HCID66966767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-d79b90d6730e415fbf8daa0c7237133e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[CH3:22][c:23]1[cH:24][n:25][cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31]1.[CH3:32][CH2:33][N:34]=[C:35]=[N:36][CH2:37][CH2:38][CH2:39][N:40]([CH3:41])[CH3:42].[CH3:53][CH2:54][O:55][C:56]([CH3:57])=[O:58].[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][c:16]([C:18](=[O:19])[NH:20][NH2:21])[cH:17]3)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:59].[OH:43][n:44]1[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[n:51][n:52]1>>[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][c:16]([C:18](=[O:19])[NH:20][NH:21][C:28]([c:27]2[cH:26][n:25][cH:24][c:23]([CH3:22])[cH:31]2)=[O:29])[cH:17]3)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1