HRID1137415

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID6228

N,N-Dimethylformamide

C3H7NO

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+

HCID612716

4-(2,4,6-Trimethyl-phenyl)-thiazol-2-ylamine

C12H14N2S

HCID2794663

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C)c(-c2csc(NC(=O)C3Cc4ccccc4N3C(=O)OC(C)(C)C)n2)c(C)c1

HCID21249482

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7563099630c644cd9f2531411187ed42
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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