HRID93076

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3776

Isopropanol

C3H8O

HCID8471

Triethylamine

C6H15N

HCID12019

3-Pentanamine

C5H13N

HCID31374

Dimethylacetamide

C4H9NO

HCID11638818

未命名化合物

PRODUCTS

产物

HCID9801039

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bbe61cd7b5db428da7e9cec93428154b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH3:38][N:39]([CH3:40])[C:41](=[O:42])[CH3:43].[CH:44]([OH:45])([CH3:46])[CH3:47].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[n:7]1[n:8][c:9]([CH3:20])[c:10]3-[c:11]1[c:12]([Cl:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)[CH2:21][CH2:22][CH2:23]2.[NH2:31][CH:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[OH2:37]>>[c:2]1([NH:31][CH:32]([CH2:33][CH3:34])[CH2:35][CH3:36])[c:3]2[c:4]([n:5][c:6]3[n:7]1[n:8][c:9]([CH3:20])[c:10]3-[c:11]1[c:12]([Cl:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)[CH2:21][CH2:22][CH2:23]2