HRID2322822

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8083

Morpholine

C4H9NO

HCID9886

Hexafluorophosphate ion

F6P-

结构：CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

HCID59754690

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccc(Nc2nc(Br)cn3ccnc23)cc1)N1CCOCC1

HCID59754722

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5de3f756a29b4d93b7ab28ce643b005c
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:1][c:2]1[n:3][c:4]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[OH:18])[cH:19][cH:20]2)[c:5]2[n:6]([cH:7]1)[cH:8][cH:9][n:10]2.[CH2:48]1[CH2:49][O:50][CH2:51][CH2:52][NH:53]1.[OH2:54].[P-:21]([F:22])([F:23])([F:24])([F:25])([F:26])[F:27].[n:28]1([O:29][P+:30]([N:31]([CH3:32])[CH3:33])([N:34]([CH3:35])[CH3:36])[N:37]([CH3:38])[CH3:39])[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1>>[Br:1][c:2]1[n:3][c:4]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:18])[N:53]3[CH2:48][CH2:49][O:50][CH2:51][CH2:52]3)[cH:19][cH:20]2)[c:5]2[n:6]([cH:7]1)[cH:8][cH:9][n:10]2