HRID139747

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

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

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

HCID10197614

2-FLUORO-CYCLOPROPANAMINE

C3H6FN

结构：CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c(C(=O)O)cc23)cc1F

HCID22936395

未命名化合物

PRODUCTS

生成物

结构：CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c(C(=O)NC4CC4F)cc23)cc1F

HCID58930942

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ead01cda05446718370877eafcec653
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([F:28])[cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][n:14][c:15]3[cH:16][c:17]([O:24][CH3:25])[c:18]([C:21](=[O:22])[OH:23])[cH:19][c:20]23)[cH:26][cH:27]1)=[O:29].[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[F:30][CH:31]1[CH:32]([NH2:34])[CH2:33]1.[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:42]1([O:43][P+:44]([N:45]([CH3:46])[CH3:47])([N:48]([CH3:49])[CH3:50])[N:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([F:28])[cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][n:14][c:15]3[cH:16][c:17]([O:24][CH3:25])[c:18]([C:21](=[O:23])[NH:34][CH:32]4[CH:31]([F:30])[CH2:33]4)[cH:19][c:20]23)[cH:26][cH:27]1)=[O:29]