HRID684200

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31374

Dimethylacetamide

C4H9NO

HCID74372

Benzoyl chloride, 4-(1,1-dimethylethyl)-

C11H13ClO

HCID81531

Diisopropylethylamine

C8H19N

HCID58336395

未命名化合物

PRODUCTS

生成物

结构：CNc1nccc(-c2cc(NC(=O)c3ccc(C(C)(C)C)cc3)c3cc(OC)ccc3c2)n1

HCID67306231

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-820401fa70204c3c866891a894022803
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

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