HRID698847

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID66967084

Methyl(2-methylbenzofuran-3-ylmethyl)amine

C11H13NO

HCID66967099

未命名化合物

PRODUCTS

生成物

结构：Cc1oc2ccccc2c1CN(C)C(=O)C=Cc1cnc2c(c1)OCC(=O)N2

HCID66967661

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0e4f8e23f1ef42cd8a68d233d1c1df56
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

[CH3:1][NH:2][CH2:3][c:4]1[c:5]([CH3:13])[o:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2.[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[O:14]=[C:15]1[NH:16][c:17]2[c:18]([cH:21][c:22]([CH:25]=[CH:26][C:27](=[O:28])[OH:29])[cH:23][n:24]2)[O:19][CH2:20]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:54].[OH:30][n:31]1[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[CH3:1][N:2]([CH2:3][c:4]1[c:5]([CH3:13])[o:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2)[C:27]([CH:26]=[CH:25][c:22]1[cH:21][c:18]2[c:17]([n:24][cH:23]1)[NH:16][C:15](=[O:14])[CH2:20][O:19]2)=[O:28]