HRID117689

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

HCID26255

Tetrafluoroborate

BF4-

HCID130500

O-benzotriazol-1-yl-tetramethyluronium

C11H16N5O+

HCID5083931

4-Methyl-3-thiopheneboronic acid

C5H7BO2S

HCID44514746

未命名化合物

HCID66914550

未命名化合物

PRODUCTS

产物

HCID44516282

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-808772f42c4f40a4846e3f3311479513
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

[B-:40]([F:41])([F:42])([F:43])[F:44].[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:16]([c:17]3[c:18]4[n:19][cH:20][cH:21][n:22][c:23]4[c:24](-[c:25]4[c:26]([Cl:27])[c:28]([O:29][CH3:30])[cH:31][c:32]([O:33][CH3:34])[c:35]4[Cl:36])[cH:37][cH:38]3)=[O:39])[n:13][cH:14]2)[CH2:6][CH2:7]1.[CH3:62][c:63]1[c:64](-[c:68]2[cH:69][cH:70][c:71]([C:78](=[O:79])[OH:80])[c:72]3[n:73][cH:74][cH:75][n:76][c:77]23)[cH:65][s:66][cH:67]1.[CH3:81][c:82]1[c:83]([B:84]([OH:85])[OH:86])[cH:87][s:88][cH:89]1.[CH3:93][OH:94].[Cl:90][CH2:91][Cl:92].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:78]([c:71]3[cH:70][cH:69][c:68](-[c:64]4[c:63]([CH3:62])[cH:67][s:66][cH:65]4)[c:77]4[c:72]3[n:73][cH:74][cH:75][n:76]4)=[O:80])[n:13][cH:14]2)[CH2:6][CH2:7]1