HRID1142196

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6456

Trityl chloride

C19H15Cl

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID178418794

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ncn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID57424168

Ethyl 1-(triphenylmethyl)-1H-1,2,4-triazole-3-carboxylate

C24H21N3O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-48293f90ab034700b6f90e7f746d6000
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[Cl:39].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][nH:8][cH:9][n:10]1.[CH2:46]([O:47][C:48](=[O:49])[CH3:50])[CH3:51].[CH:11]([N:12]([CH2:13][CH3:14])[CH:15]([CH3:16])[CH3:17])([CH3:18])[CH3:19].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[OH2:40]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8]([C:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)([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)[cH:9][n:10]1