HRID2160509

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID84189

Ethoxyacetyl chloride

C4H7ClO2

反应SMILES：Cc1cc(NCCOCCCc2cccnc2)c(N)c(Oc2ccccc2)n1

HCID69410568

未命名化合物

PRODUCTS

产物

反应SMILES：CCOCC(=O)Nc1c(NCCOCCCc2cccnc2)cc(C)nc1Oc1ccccc1

HCID21913385

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e9d834f75fa04d67905e7fd97ff29c74
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[CH2:36]([CH3:37])[O:38][CH2:39][C:40](=[O:41])[Cl:42].[CH3:1][c:2]1[cH:3][c:4]([NH:16][CH2:17][CH2:18][O:19][CH2:20][CH2:21][CH2:22][c:23]2[cH:24][n:25][cH:26][cH:27][cH:28]2)[c:5]([NH2:15])[c:6]([O:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:7]1.[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[Cl:43][CH2:44][Cl:45]>>[CH3:1][c:2]1[cH:3][c:4]([NH:16][CH2:17][CH2:18][O:19][CH2:20][CH2:21][CH2:22][c:23]2[cH:24][n:25][cH:26][cH:27][cH:28]2)[c:5]([NH:15][C:40]([CH2:39][O:38][CH2:36][CH3:37])=[O:41])[c:6]([O:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:7]1