HRID209749

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID10465394

未命名化合物

结构：Cc1c(CCl)ncn1C(c1ccccc1)(c1ccccc1)c1ccccc1

HCID11046965

4-(Chloromethyl)-5-methyl-1-trityl-1H-imidazole

C24H21ClN2

PRODUCTS

生成物

结构：Cc1c2n(c3ccccc13)C(=O)N(Cc1ncn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c1C)CC2

HCID10030116

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5432a2433d49476780f0162f13d5be9f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:1][c:2]1[c:3]2[n:4]([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]13)[C:11](=[O:15])[NH:12][CH2:13][CH2:14]2.[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Cl:18][CH2:19][c:20]1[n:21][cH:22][n:23]([C:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:24]1[CH3:25].[H-:16].[Na+:17].[OH2:50]>>[CH3:1][c:2]1[c:3]2[n:4]([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]13)[C:11](=[O:15])[N:12]([CH2:19][c:20]1[n:21][cH:22][n:23]([C:26]([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[c:24]1[CH3:25])[CH2:13][CH2:14]2