HRID2334966

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID73042

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

C12H20N4O2

HCID854140

tert-Butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate

C12H23NO3

HCID59557950

4-[5-Amino-3-(1,1-dimethylethyl)-1H-pyrazol-1-yl]phenol

C13H17N3O

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(CCOc2ccc(-n3nc(C(C)(C)C)cc3N)cc2)CC1

HCID53630192

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71cc04ccc9774f65a12d07cc8db0c13a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23](=[O:24])[N:25]1[CH2:26][CH2:27][CH:28]([CH2:31][CH2:32][OH:33])[CH2:29][CH2:30]1.[CH2:71]1[O:72][CH2:73][CH2:74][CH2:75]1.[N:34]([C:35]([N:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1)=[O:42])=[N:43][C:44]([N:45]1[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]1)=[O:51].[NH2:1][c:2]1[cH:3][c:4]([C:14]([CH3:15])([CH3:16])[CH3:17])[n:5][n:6]1-[c:7]1[cH:8][cH:9][c:10]([OH:13])[cH:11][cH:12]1.[c:52]1([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:66][cH:67][cH:68][cH:69][cH:70]1>>[NH2:1][c:2]1[cH:3][c:4]([C:14]([CH3:15])([CH3:16])[CH3:17])[n:5][n:6]1-[c:7]1[cH:8][cH:9][c:10]([O:13][CH2:32][CH2:31][CH:28]2[CH2:27][CH2:26][N:25]([C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:24])[CH2:30][CH2:29]2)[cH:11][cH:12]1