HRID2312910

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID144895

2,4,6-Trifluorobenzoyl chloride

C7H2ClF3O

反应SMILES：NCc1c[nH]c(-c2ccc(F)cc2)c1-c1ccncc1

HCID21922757

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(NCc1c[nH]c(-c2ccc(F)cc2)c1-c1ccncc1)c1c(F)cc(F)cc1F

HCID21922815

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-835f8c06af884a7dba2fe1291f7fe4ab
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

[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[ClH:20].[ClH:21].[F:8][c:9]1[c:10]([C:11](=[O:12])[Cl:13])[c:14]([F:19])[cH:15][c:16]([F:18])[cH:17]1.[NH2:22][CH2:23][c:24]1[c:25](-[c:36]2[cH:37][cH:38][n:39][cH:40][cH:41]2)[c:26](-[c:29]2[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]2)[nH:27][cH:28]1.[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[OH2:42]>>[F:8][c:9]1[c:10]([C:11](=[O:12])[NH:22][CH2:23][c:24]2[c:25](-[c:36]3[cH:37][cH:38][n:39][cH:40][cH:41]3)[c:26](-[c:29]3[cH:30][cH:31][c:32]([F:35])[cH:33][cH:34]3)[nH:27][cH:28]2)[c:14]([F:19])[cH:15][c:16]([F:18])[cH:17]1