HRID101332

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8003

Pentane

C5H12

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID11402861

4-Methoxy-7-morpholinobenzo[d]thiazol-2-amine

C12H15N3O2S

HCID58592590

未命名化合物

HCID178418306

未命名化合物

PRODUCTS

生成物

结构：COCCN(C)Cc1ncc(C(=O)Nc2nc3c(OC)ccc(N4CCOCC4)c3s2)n1C

HCID11612582

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-07251a271a424ac69ffa8722787c3d74
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

[C:19]([Li:20])([CH3:21])([CH3:22])[CH3:23].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[c:7]2[c:8]1[n:9][c:10]([NH2:12])[s:11]2.[CH3:53][CH2:54][CH2:55][CH2:56][CH3:57].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[Cl-:46].[NH4+:47].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[c:24]1([O:30][C:31](=[O:25])[c:33]2[n:34]([CH3:45])[c:35]([CH2:38][N:39]([CH3:40])[CH2:41][CH2:42][O:43][CH3:44])[n:36][cH:37]2)[cH:26][cH:27][cH:28][cH:29][cH:32]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[c:7]2[c:8]1[n:9][c:10]([NH:12][C:31](=[O:30])[c:33]1[n:34]([CH3:45])[c:35]([CH2:38][N:39]([CH3:40])[CH2:41][CH2:42][O:43][CH3:44])[n:36][cH:37]1)[s:11]2