HRID1132619

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID82634977

未命名化合物

HCID178480299

未命名化合物

PRODUCTS

生成物

结构：CCOc1ccc(C(F)(F)F)cc1C(=O)N=c1cc(C(C)(C)C)n(C)n1CC1CCCO1

HCID178466558

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-966f8da9a3c94ef8a2e8a0e9465ebfb7
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](=[NH:17])[n:8]([CH2:11][CH:12]2[O:13][CH2:14][CH2:15][CH2:16]2)[n:9]1[CH3:10].[CH2:25]([CH3:26])[O:27][c:28]1[c:29]([C:30](=[O:31])[Cl:32])[cH:33][c:34]([C:37]([F:38])([F:39])[F:40])[cH:35][cH:36]1.[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](=[N:17][C:30]([c:29]2[c:28]([O:27][CH2:25][CH3:26])[cH:36][cH:35][c:34]([C:37]([F:38])([F:39])[F:40])[cH:33]2)=[O:31])[n:8]([CH2:11][CH:12]2[O:13][CH2:14][CH2:15][CH2:16]2)[n:9]1[CH3:10]