HRID1116050

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID27946

1-Pyrrolidinamine

C4H10N2

HCID12684341

2-Chloro-4-methoxyquinazoline

C9H7ClN2O

HCID67444238

未命名化合物

PRODUCTS

生成物

结构：COc1nc(NC2CCN(C(=O)Cc3ccc(OC(F)(F)F)cc3)C2)nc2ccccc12

HCID67442867

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cda625ce0ba44b4b82646736bbabb4fe
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

[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH:48]([Cl:49])([Cl:50])[Cl:51].[Cl:7][c:8]1[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[c:16]([O:18][CH3:19])[n:17]1.[ClH:20].[NH2:1][N:2]1[CH2:3][CH2:4][CH2:5][CH2:6]1.[NH2:21][CH:22]1[CH2:23][N:24]([C:27]([CH2:28][c:29]2[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]2)=[O:40])[CH2:25][CH2:26]1>>[c:8]1([NH:21][CH:22]2[CH2:23][N:24]([C:27]([CH2:28][c:29]3[cH:30][cH:31][c:32]([O:35][C:36]([F:37])([F:38])[F:39])[cH:33][cH:34]3)=[O:40])[CH2:25][CH2:26]2)[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[c:16]([O:18][CH3:19])[n:17]1