HRID1561328

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID7330471

2,3-dimethylpyridin-4-amine

C7H10N2

HCID58404868

未命名化合物

PRODUCTS

生成物

结构：COc1cc(-c2cnn(C)c2)cn2ncc(C(=O)Nc3ccnc(C)c3C)c12

HCID58404727

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c13e9bf4825a459cbc0cb07ca9e2ee90
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:1][O:2][c:3]1[c:4]2[n:5]([cH:6][c:7](-[c:9]3[cH:10][n:11][n:12]([CH3:14])[cH:13]3)[cH:8]1)[n:15][cH:16][c:17]2[C:18](=[O:19])[OH:20].[CH3:21][c:22]1[n:23][cH:24][cH:25][c:26]([NH2:29])[c:27]1[CH3:28].[CH3:46][N:47]([CH3:48])[c:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1.[CH3:55][S:56]([CH3:57])=[O:58].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[OH2:30].[OH2:59].[n:31]1([OH:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[CH3:1][O:2][c:3]1[c:4]2[n:5]([cH:6][c:7](-[c:9]3[cH:10][n:11][n:12]([CH3:14])[cH:13]3)[cH:8]1)[n:15][cH:16][c:17]2[C:18](=[O:20])[NH:29][c:26]1[cH:25][cH:24][n:23][c:22]([CH3:21])[c:27]1[CH3:28]