HRID197563

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8058

n-Hexane

C6H14

HCID10448

3-(Methylthio)-1-propanol

C4H10OS

HCID13831

Tributylphosphine

C12H27P

HCID73042

1,1′-(1,2-Diazenediyl)bis[1-(1-piperidinyl)methanone]

C12H20N4O2

HCID81970

4-Bromo-3,5-xylenol

C8H9BrO

PRODUCTS

生成物

HCID59342575

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-31699446aa1f4f7da5b6a2c8b0177b58
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

[Br:1][c:2]1[c:3]([CH3:10])[cH:4][c:5]([OH:9])[cH:6][c:7]1[CH3:8].[CH2:17]([P:18]([CH2:19][CH2:20][CH2:21][CH3:22])[CH2:23][CH2:24][CH2:25][CH3:26])[CH2:27][CH2:28][CH3:29].[CH3:11][S:12][CH2:13][CH2:14][CH2:15][OH:16].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[CH3:55][CH2:56][CH2:57][CH2:58][CH2:59][CH3:60].[N:30]([C:31]([N:32]1[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]1)=[O:38])=[N:39][C:40]([N:41]1[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1)=[O:47]>>[Br:1][c:2]1[c:3]([CH3:10])[cH:4][c:5]([O:9][CH2:15][CH2:14][CH2:13][S:12][CH3:11])[cH:6][c:7]1[CH3:8]