HRID117672

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID3019023

3-Amino-N-(propan-2-yl)benzene-1-carboximidic acid

C10H14N2O

反应SMILES：CN(C)C(On1nnc2cccnc21)=[N+](C)C

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

反应SMILES：Cc1c[nH]c2ncnc(N3CCC(C)(C(=O)O)CC3)c12

HCID67036781

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1c[nH]c2ncnc(N3CCC(C)(C(=O)Nc4cccc(C(=O)NC(C)C)c4)CC3)c12

HCID44478472

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-578f6e15c2be46dcb4f918ea1b27e763
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

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