HRID198865

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID23938

Palladium

HCID31275

1,4-Dioxane

C4H8O2

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

2 次

HCID151064

2,3-Dihydro-1,4-benzothiazine

C8H9NS

HCID4574913

未命名化合物

HCID59138879

未命名化合物

PRODUCTS

生成物

结构：c1cncc(N(Cc2cccnc2N2CCSc3ccccc32)c2cccnc2)c1

HCID24877535

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8a3576feb4f94fb7ad003b025a29e623
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:48]([P:49]([C:50]([CH3:51])([CH3:52])[CH3:53])[C:54]([CH3:55])([CH3:56])[CH3:57])([CH3:58])([CH3:59])[CH3:60].[C:61]([P:62]([C:63]([CH3:64])([CH3:65])[CH3:66])[C:67]([CH3:68])([CH3:69])[CH3:70])([CH3:71])([CH3:72])[CH3:73].[CH2:44]([Cl:45])[Cl:46].[CH3:32][C:33]([CH3:34])([O-:35])[CH3:36].[Cl:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[CH2:8][N:9]([c:10]1[cH:11][n:12][cH:13][cH:14][cH:15]1)[c:16]1[cH:17][n:18][cH:19][cH:20][cH:21]1.[Na+:37].[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[Pd:47].[S:22]1[CH2:23][CH2:24][NH:25][c:26]2[c:27]1[cH:28][cH:29][cH:30][cH:31]2>>[c:2]1([N:25]2[CH2:24][CH2:23][S:22][c:27]3[c:26]2[cH:31][cH:30][cH:29][cH:28]3)[n:3][cH:4][cH:5][cH:6][c:7]1[CH2:8][N:9]([c:10]1[cH:11][n:12][cH:13][cH:14][cH:15]1)[c:16]1[cH:17][n:18][cH:19][cH:20][cH:21]1