HRID2332670

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID217242

2-Amino-1-(4-amino-3,5-dichlorophenyl)ethan-1-ol

C8H10Cl2N2O

HCID23045257

未命名化合物

PRODUCTS

生成物

结构：Nc1c(Cl)cc(C(O)CNCCCCCCOCCSCCc2ccccn2)cc1Cl

HCID23045272

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-77379994e2884a4e9f587174ad71f1c5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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