HRID695214

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID887

Methanol

CH4O

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)(C)OC(=O)NC(COc1noc2ccc(Cl)cc12)Cc1cc(OS(=O)(=O)c2ccccc2)no1

HCID23368490

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(COc1noc2ccc(Cl)cc12)Cc1cc(O)no1

HCID178453744

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6304fae1c9724eb3a4b77c276ba37bc2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][O:11][c:12]1[n:13][o:14][c:15]2[c:16]1[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[CH2:22][c:23]1[cH:24][c:25]([O:28][S:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)(=[O:36])=[O:37])[n:26][o:27]1.[CH3:38][OH:39].[NH3:40].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][O:11][c:12]1[n:13][o:14][c:15]2[c:16]1[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[CH2:22][c:23]1[cH:24][c:25]([OH:28])[n:26][o:27]1