HRID816562

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID78373

Methanamine, 1,1-dimethoxy-N,N-dimethyl-

C5H13NO2

结构：Cc1c[nH]c2ncnc(N3CCN(C(=NS(N)(=O)=O)Nc4cccc(Br)c4)C(C)C3)c12

HCID68784225

未命名化合物

PRODUCTS

生成物

结构：Cc1c[nH]c2ncnc(N3CCN(C(=NS(=O)(=O)N=CN(C)C)Nc4cccc(Br)c4)C(C)C3)c12

HCID68963971

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-056119b641804c2d9286e369cce04204
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([NH:8][C:9](=[N:10][S:11]([NH2:12])(=[O:13])=[O:14])[N:15]2[CH:16]([CH3:31])[CH2:17][N:18]([c:21]3[c:22]4[c:23]([n:24][cH:25][n:26]3)[nH:27][cH:28][c:29]4[CH3:30])[CH2:19][CH2:20]2)[cH:5][cH:6][cH:7]1.[CH3:32][O:33][CH:34]([N:35]([CH3:36])[CH3:37])[O:38][CH3:39].[CH3:40][OH:41]>>[Br:1][c:2]1[cH:3][c:4]([NH:8][C:9](=[N:10][S:11]([N:12]=[CH:34][N:35]([CH3:36])[CH3:37])(=[O:13])=[O:14])[N:15]2[CH:16]([CH3:31])[CH2:17][N:18]([c:21]3[c:22]4[c:23]([n:24][cH:25][n:26]3)[nH:27][cH:28][c:29]4[CH3:30])[CH2:19][CH2:20]2)[cH:5][cH:6][cH:7]1