HRID1555986

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID674

Dimethylamine

C2H7N

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

结构：Cc1ccc(S(=O)(=O)OCC2Cc3c(OC(C)C)cc(C(=O)Nc4ccn(C)n4)cc3O2)cc1

HCID59560417

未命名化合物

PRODUCTS

生成物

结构：CC(C)Oc1cc(C(=O)Nc2ccn(C)n2)cc2c1CC(CN(C)C)O2

HCID59560082

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6f531ebefe0c4887946261764f388a51
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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