HRID1115930

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID13831

Tributylphosphine

C12H27P

HCID73042

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

C12H20N4O2

HCID268786

5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ol

C14H20O

结构：Cc1nccn1-c1nc(-c2ccc(Cl)cc2)c(CCCO)o1

HCID9926997

4-(4-chlorophenyl)-2-(2-methyl-1-imidazolyl)-5-oxazolepropanol

C16H16ClN3O2

PRODUCTS

生成物

结构：Cc1nccn1-c1nc(-c2ccc(Cl)cc2)c(CCCOc2ccc3c(c2)C(C)(C)CCC3(C)C)o1

HCID18174768

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-50fd793cba404d4ca2e1389eda67b7b2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:38]([P:39]([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH3:50].[CH3:23][C:24]1([CH3:37])[c:25]2[cH:26][cH:27][c:28]([OH:36])[cH:29][c:30]2[C:31]([CH3:34])([CH3:35])[CH2:32][CH2:33]1.[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10](-[n:17]3[c:18]([CH3:22])[n:19][cH:20][cH:21]3)[o:11][c:12]2[CH2:13][CH2:14][CH2:15][OH:16])[cH:6][cH:7]1.[N:51]([C:52]([N:53]1[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]1)=[O:59])=[N:60][C:61]([N:62]1[CH2:63][CH2:64][CH2:65][CH2:66][CH2:67]1)=[O:68].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10](-[n:17]3[c:18]([CH3:22])[n:19][cH:20][cH:21]3)[o:11][c:12]2[CH2:13][CH2:14][CH2:15][O:16][c:28]2[cH:27][cH:26][c:25]3[c:30]([cH:29]2)[C:31]([CH3:34])([CH3:35])[CH2:32][CH2:33][C:24]3([CH3:23])[CH3:37])[cH:6][cH:7]1