HRID697775

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID11542827

2,3-Dimethyl-2H-indazol-6-amine

C9H11N3

HCID16682925

Aluminum, trimethyl-

C3H9Al

反应SMILES：COC(=O)c1ccccc1NCc1ccnc(NC(=O)N(C)C)c1

HCID67051939

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1c2ccc(NC(=O)c3ccccc3NCc3ccnc(NC(=O)N(C)C)c3)cc2nn1C

HCID11712238

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5eb516ab33ee47098a6a95d5f88e0da2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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