HRID110549

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

HCID2763971

2-Amino-3-bromo-5-chloropyridine

C5H4BrClN2

HCID21895383

N-Methylethenesulfonamide

C3H7NO2S

PRODUCTS

生成物

HCID54242130

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c772f3cdf6b24021b7e0836f21bd0c62
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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