HRID836278

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6342

Acetonitrile

C2H3N

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

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

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

HCID12490703

未命名化合物

结构：O=C(O)c1ccc(-c2cnc3ncc(Cc4ccc5ncccc5c4)n3n2)cc1F

HCID57971177

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)C(NC(=O)c1ccc(-c2cnc3ncc(Cc4ccc5ncccc5c4)n3n2)cc1F)C(C)(C)C

HCID178451280

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-af46bb6ee74b4f4f8750609a7dcb5b0b
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:81][N:82]([CH3:83])[CH:84]=[O:85].[CH3:86][C:87]#[N:88].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:40].[F:10][c:11]1[c:12]([C:13](=[O:14])[OH:15])[cH:16][cH:17][c:18](-[c:20]2[cH:21][n:22][c:23]3[n:24]([n:25]2)[c:26]([CH2:29][c:30]2[cH:31][c:32]4[cH:33][cH:34][cH:35][n:36][c:37]4[cH:38][cH:39]2)[cH:27][n:28]3)[cH:19]1.[NH2:41][CH:42]([C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[C:50]([CH3:51])([CH3:52])[CH3:53].[P-:54]([F:55])([F:56])([F:57])([F:58])([F:59])[F:60].[n:61]1([O:62][P+:63]([N:64]([CH3:65])[CH3:66])([N:67]([CH3:68])[CH3:69])[N:70]([CH3:71])[CH3:72])[c:73]2[cH:74][cH:75][cH:76][cH:77][c:78]2[n:79][n:80]1>>[F:10][c:11]1[c:12]([C:13](=[O:14])[NH:41][CH:42]([C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[C:50]([CH3:51])([CH3:52])[CH3:53])[cH:16][cH:17][c:18](-[c:20]2[cH:21][n:22][c:23]3[n:24]([n:25]2)[c:26]([CH2:29][c:30]2[cH:31][c:32]4[cH:33][cH:34][cH:35][n:36][c:37]4[cH:38][cH:39]2)[cH:27][n:28]3)[cH:19]1