HRID1564001

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID12919092

未命名化合物

反应SMILES：CC(C)C(C(=O)O)c1cnc(C(C)(C)C)nc1

HCID13911492

未命名化合物

PRODUCTS

产物

反应SMILES：C#CC(OC(=O)C(c1cnc(C(C)(C)C)nc1)C(C)C)c1cccc(Oc2ccccc2)c1

HCID13911493

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ee6704c8a4b44d039a56c330e150f00a
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

[C:33](#[CH:34])[CH:35]([c:36]1[cH:37][c:38]([O:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:39][cH:40][cH:41]1)[OH:49].[CH3:16][C:17]([CH3:18])([CH3:19])[c:20]1[n:21][cH:22][c:23]([CH:26]([C:27](=[O:28])[OH:29])[CH:30]([CH3:31])[CH3:32])[cH:24][n:25]1.[CH3:53][N:54]([CH3:55])[c:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1.[CH:1]1([N:2]=[C:3]=[N:4][CH:5]2[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1.[Cl:50][CH2:51][Cl:52]>>[CH3:16][C:17]([CH3:18])([CH3:19])[c:20]1[n:21][cH:22][c:23]([CH:26]([C:27](=[O:28])[O:29][CH:35]([C:33]#[CH:34])[c:36]2[cH:37][c:38]([O:42][c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[cH:39][cH:40][cH:41]2)[CH:30]([CH3:31])[CH3:32])[cH:24][n:25]1