HRID1233091

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID104454

Ethyl 2-aminothiazol-4-acetate

C7H10N2O2S

结构：COc1ccc(C)cc1S(=O)(=O)N1CCCc2ccc(C(=O)O)cc21

HCID68433807

1-(2-Methoxy-5-methyl-benzenesulfonyl)-1,2,3,4-tetrahydro-quinoline-7-carboxylic acid

C18H19NO5S

PRODUCTS

生成物

结构：CCOC(=O)Cc1csc(NC(=O)c2ccc3c(c2)N(S(=O)(=O)c2cc(C)ccc2OC)CCC3)n1

HCID86761181

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ccca00ba1214860a20f9e6a3c2013f9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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