HRID2140682

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID21938415

3-Chloro-4,7-difluorobenzo[b]thiophene-2-carbonyl chloride

C9H2Cl2F2OS

HCID59683529

未命名化合物

PRODUCTS

产物

HCID59683616

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0984b92a52c14e7d9024ccdd3d1cfcce
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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