HRID1210222

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6342

Acetonitrile

C2H3N

HCID6422

未命名化合物

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+

HCID2756716

1-([1,1'-Biphenyl]-4-yl)-N-methyl-2-(pyrrolidin-1-yl)ethan-1-amine

C19H24N2

HCID3028194

Lithium

HCID57488854

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(c1)OCC(=O)N2CC(=O)N(C)C(CN1CCCC1)c1ccc(-c2ccccc2)cc1

HCID46941284

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63a591ba487a48a5837caa29f09748c8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([cH:16][cH:17]1)[N:7]([CH2:12][C:13](=[O:14])[OH:15])[C:8](=[O:11])[CH2:9][O:10]2.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:81][C:82]#[N:83].[Li:18].[O:85]=[CH:86][N:87]([CH3:88])[CH3:89].[OH2:84].[OH:74][C:75]([C:76]([F:77])([F:78])[F:79])=[O:80].[P-:47]([F:48])([F:49])([F:50])([F:51])([F:52])[F:53].[c:19]1(-[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:20][cH:21][c:22]([CH:25]([CH2:26][N:27]2[CH2:28][CH2:29][CH2:30][CH2:31]2)[NH:32][CH3:33])[cH:23][cH:24]1.[n:54]1([O:55][P+:56]([N:57]([CH3:58])[CH3:59])([N:60]([CH3:61])[CH3:62])[N:63]([CH3:64])[CH3:65])[c:66]2[cH:67][cH:68][cH:69][cH:70][c:71]2[n:72][n:73]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([cH:16][cH:17]1)[N:7]([CH2:12][C:13](=[O:15])[N:32]([CH:25]([c:22]1[cH:21][cH:20][c:19](-[c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[cH:24][cH:23]1)[CH2:26][N:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1)[CH3:33])[C:8](=[O:11])[CH2:9][O:10]2