HRID185288

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8082

Piperidine

C5H11N

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

结构：O=C(O)c1nc(-n2cnc3ccc(F)cc32)nc2c1[nH]c(=O)n2C1CCOCC1

HCID57612655

未命名化合物

PRODUCTS

生成物

结构：O=C(c1nc(-n2cnc3ccc(F)cc32)nc2c1[nH]c(=O)n2C1CCOCC1)N1CCCCC1

HCID57612702

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cd5940e2cd174089b9c98053ad6cefd0
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

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