HRID111403

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID15891

Phenyl carbonochloridate

C7H5ClO2

HCID19660

Carbonate

CO3-2

结构：CCOC(=O)c1cccc(-n2nc(C(C)(C)C)cc2N)c1

HCID21867322

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cccc(-n2nc(C(C)(C)C)cc2NC(=O)Oc2ccccc2)c1

HCID59234717

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c76027c9b9a449ee8a5303574c9b43cf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[Cl:28][C:29](=[O:30])[O:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[K+:22].[K+:23].[NH2:1][c:2]1[cH:3][c:4]([C:18]([CH3:19])([CH3:20])[CH3:21])[n:5][n:6]1-[c:7]1[cH:8][c:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[cH:15][cH:16][cH:17]1.[O-:24][C:25]([O-:26])=[O:27]>>[NH:1]([c:2]1[cH:3][c:4]([C:18]([CH3:19])([CH3:20])[CH3:21])[n:5][n:6]1-[c:7]1[cH:8][c:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[cH:15][cH:16][cH:17]1)[C:29](=[O:30])[O:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1