HRID135189

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

5 次

HCID12052

Silane, triethyl-

C6H16Si

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

结构：O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-]

HCID3440921

Triphosphate

O10P3-5

结构：O=C(Nc1ccc(N2CCC2)nc1)c1cc2cc(Br)ccc2n1Cc1cccc(F)c1

HCID66850586

未命名化合物

PRODUCTS

生成物

结构：CC[Si](CC)(CC)c1ccc2c(c1)cc(C(=O)Nc1ccc(N3CCC3)nc1)n2Cc1cccc(F)c1

HCID66850699

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a5b2a667686e4539b370e146fac9fa8d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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