HRID686687

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6422

未命名化合物

HCID8471

Triethylamine

C6H15N

HCID56832319

4-(5-Chloro-1,2,4-thiadiazol-3-yl)morpholine

C6H8ClN3OS

HCID68724237

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1noc2ccccc12)N1CCN(c2nc(N3CCOCC3)ns2)CC1

HCID68781122

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c15217b19c3346488bb1a1a372151e7a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cl:1][c:2]1[n:3][c:4]([N:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[n:5][s:6]1.[F:13][C:14]([F:15])([F:16])[C:17]([OH:18])=[O:19].[OH2:45].[o:20]1[n:21][c:22]([NH:29][C:30](=[O:31])[N:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[c:23]2[c:24]1[cH:25][cH:26][cH:27][cH:28]2>>[c:2]1([N:35]2[CH2:34][CH2:33][N:32]([C:30]([NH:29][c:22]3[n:21][o:20][c:24]4[c:23]3[cH:28][cH:27][cH:26][cH:25]4)=[O:31])[CH2:37][CH2:36]2)[n:3][c:4]([N:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[n:5][s:6]1