HRID1140748

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID81531

Diisopropylethylamine

C8H19N

HCID2764165

1-(3-Phenyl-1,2-oxazol-5-yl)methanamine

C10H10N2O

HCID57866451

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1cc(Nc2cc(Cl)nc(NCc3cc(-c4ccccc4)no3)n2)n[nH]1

HCID57866448

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7794283ebd14098aa26b8daf955d8c7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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