HRID294868

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

结构：CCCn1c(=O)c2c(nc(-c3cnn(CC4CC(=O)N(c5ccc(C(C)C)cc5)C4)c3)n2COCC[Si](C)(C)C)n(CCC)c1=O

HCID57988783

未命名化合物

PRODUCTS

生成物

结构：CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(C)C)cc5)C4)c3)nc2n(CCC)c1=O

HCID57988759

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-caf69acb644d4732ab33ac2964267b54
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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