HRID98334

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2155

2-Aminothiazole

C3H4N2S

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID22467897

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1nccs1)C(CC1CCCC1)c1ccc(N2CCOCC2)cc1

HCID22467928

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b44df2d1208a4d75aae3afe03583a936
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

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