HRID1225207

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7054

Isatin

C8H5NO2

HCID699799

2-methyl-1,3-benzothiazol-5-ol

C8H7NOS

HCID9115273

2,3-dihydrobenzo[b][1,4]dioxin-6-ol

C8H8O3

结构：O=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2cccc(F)c21

HCID68596811

未命名化合物

PRODUCTS

生成物

结构：O=C1N(C(c2ccccc2)c2ccccc2)c2cccc(F)c2C1(O)c1cc2c(cc1O)OCCO2

HCID67358415

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-651b0a9486d1469d82bc824c57495de7
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

[CH3:12][c:13]1[s:14][c:15]2[cH:16][cH:17][c:18]([OH:19])[cH:20][c:21]2[n:22]1.[O:1]1[c:2]2[c:3]([cH:7][c:8]([OH:11])[cH:9][cH:10]2)[O:4][CH2:5][CH2:6]1.[O:48]=[C:49]1[C:50](=[O:51])[c:52]2[c:53]([cH:54][cH:55][cH:56][cH:57]2)[NH:58]1.[c:23]1([CH:29]([N:30]2[C:31](=[O:41])[C:32](=[O:40])[c:33]3[c:34]([F:39])[cH:35][cH:36][cH:37][c:38]32)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[O:1]1[c:2]2[c:3]([cH:7][c:8]([OH:11])[c:9]([C:32]3([OH:40])[C:31](=[O:41])[N:30]([CH:29]([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)[c:38]4[c:33]3[c:34]([F:39])[cH:35][cH:36][cH:37]4)[cH:10]2)[O:4][CH2:5][CH2:6]1