HRID1563532

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID9321

Hydrazine

H4N2

HCID69110

Benzoyl chloride, 2-chloro-

C7H4Cl2O

HCID120273

N-Iodosuccinimide

C4H4INO2

HCID2783397

2-Fluoropyridine-5-boronic acid

C5H5BFNO2

HCID57433610

未命名化合物

结构：NNc1ccc(-c2c(-c3ccc(F)cc3)nc3occn23)cn1

HCID59457792

未命名化合物

PRODUCTS

生成物

结构：O=C(NNc1ccc(-c2c(-c3ccc(F)cc3)nc3occn23)cn1)c1ccccc1Cl

HCID59457868

2-Chlorobenzoic acid 2-[5-[6-(4-fluorophenyl)imidazo[2,1-b]oxazol-5-yl]-2-pyridinyl]hydrazide

C23H15ClFN5O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d83f00b591b94064a9c05024e4c4dca2
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

[CH2:69]1[O:70][CH2:71][CH2:72][CH2:73]1.[Cl:59][C:60](=[O:61])[c:62]1[cH:63][cH:64][cH:65][cH:66][c:67]1[Cl:68].[Cl:74][CH2:75][Cl:76].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[o:11][cH:12][cH:13][n:14]3[c:15]2-[c:16]2[cH:17][n:18][c:19]([NH:22][NH2:23])[cH:20][cH:21]2)[cH:6][cH:7]1.[F:24][c:25]1[cH:26][cH:27][c:28](-[c:29]2[n:30][c:31]3[n:32]([cH:33]2)[cH:34][cH:35][o:36]3)[cH:37][cH:38]1.[F:47][c:48]1[n:49][cH:50][c:51]([B:52]([OH:53])[OH:54])[cH:55][cH:56]1.[NH2:57][NH2:58].[O:39]=[C:40]1[N:41]([I:42])[C:43](=[O:44])[CH2:45][CH2:46]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[o:11][cH:12][cH:13][n:14]3[c:15]2-[c:16]2[cH:17][n:18][c:19]([NH:22][NH:23][C:60](=[O:61])[c:62]3[cH:63][cH:64][cH:65][cH:66][c:67]3[Cl:68])[cH:20][cH:21]2)[cH:6][cH:7]1