HRID303094

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID8471

Triethylamine

C6H15N

HCID22121908

4-Chloroisoquinoline-5-sulfonyl chloride

C9H5Cl2NO2S

HCID67243875

未命名化合物

PRODUCTS

产物

HCID67244999

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-59d9215912e44f6eaf851311c12bb1a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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