HRID162432

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl Acetate

C4H8O2

HCID15908

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

C8H17N3

HCID68448

4-Fluoro-1-naphthoic acid

C11H7FO2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID22261599

未命名化合物

PRODUCTS

产物

HCID22262091

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-d5bd61a1834d4efba65ee3a15cd98779
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[CH2:49]([N:50]=[C:51]=[N:52][CH2:53][CH2:54][CH2:55][N:56]([CH3:57])[CH3:58])[CH3:59].[CH3:60][C:61]#[N:62].[CH3:63][CH2:64][O:65][C:66](=[O:67])[CH3:68].[ClH:48].[F:23][c:24]1[cH:25][cH:26][c:27]([C:34](=[O:35])[OH:36])[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]12.[NH2:1][CH:2]([CH:3]([OH:4])[c:5]1[cH:6][cH:7][c:8]([F:11])[cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][c:15]([C:19]([CH3:20])([F:21])[F:22])[cH:16][cH:17][cH:18]1.[OH2:37].[OH:38][n:39]1[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1>>[NH:1]([CH:2]([CH:3]([OH:4])[c:5]1[cH:6][cH:7][c:8]([F:11])[cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][c:15]([C:19]([CH3:20])([F:21])[F:22])[cH:16][cH:17][cH:18]1)[C:34]([c:27]1[cH:26][cH:25][c:24]([F:23])[c:33]2[c:28]1[cH:29][cH:30][cH:31][cH:32]2)=[O:35]