HRID202925

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1086

Dithionite

O4S2-2

HCID6115

Aniline

C6H7N

HCID8028

Tetrahydrofuran

C4H8O

HCID8502

4-Nitrobenzoyl chloride

C7H4ClNO3

HCID19660

Carbonate

CO3-2

HCID31347

Sulfolane

C4H8O2S

HCID10976276

2-(4-Nitrophenyl)oxazole

C9H6N2O3

HCID178418936

未命名化合物

PRODUCTS

生成物

HCID12371739

4-(1,3-Oxazol-2-yl)aniline

C9H8N2O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab67752cee204e3eb7b7f56ec2af3db1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[K+:18].[K+:19].[N+:1]([c:2]1[cH:3][cH:4][c:5]([C:6]([Cl:7])=[O:8])[cH:9][cH:10]1)([O-:11])=[O:12].[NH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[Na+:51].[Na+:52].[O-:20][C:21]([O-:22])=[O:23].[OH2:65].[S:45]([S:46]([O-:47])=[O:48])([O-:49])=[O:50].[S:53]1(=[O:58])(=[O:59])[CH2:54][CH2:55][CH2:56][CH2:57]1.[nH:13]1[cH:14][cH:15][n:16][n:17]1.[o:24]1[c:25](-[c:29]2[cH:30][cH:31][c:32]([N+:35]([O-:36])=[O:37])[cH:33][cH:34]2)[n:26][cH:27][cH:28]1>>[o:24]1[c:25](-[c:29]2[cH:30][cH:31][c:32]([NH2:35])[cH:33][cH:34]2)[n:26][cH:27][cH:28]1