HRID1125062

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID3164136

Pyridine-3-sulfonyl chloride

C5H4ClNO2S

反应SMILES：Cc1ccc2c(c1)C(C)(C)CC(c1cccc(N)c1)N2

HCID67290828

未命名化合物

反应SMILES：CC1(C)CC(c2cccc(N)c2)Nc2ccc(C(F)(F)F)cc21

HCID67291615

未命名化合物

PRODUCTS

产物

反应SMILES：CC1(C)CC(c2cccc(NS(=O)(=O)c3cccnc3)c2)Nc2ccc(C(F)(F)F)cc21

HCID56966133

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f039f149e47842dc824781c5f49cc9f5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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