HRID2133287

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID53167

1-Methylpiperazine

C5H12N2

反应SMILES：CCOc1cc(OC)ccc1C1=NC(CC2CCCC2)C(c2ccc(Cl)cc2)N1C(=O)Cl

HCID21896891

未命名化合物

PRODUCTS

产物

反应SMILES：CCOc1cc(OC)ccc1C1=NC(CC2CCCC2)C(c2ccc(Cl)cc2)N1C(=O)N1CCN(C)CC1

HCID11193096

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c9cf8f11125f47dd91ae68d0504f1fb2
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

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