HRID2140415

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7901

Ethanamine, 2-chloro-N,N-dimethyl-

C4H10ClN

结构：Cc1nc(C(=O)N2CCCCC2Cc2nc3cc(F)c(F)cc3[nH]2)c(-c2ccc(F)cc2)s1

HCID17973672

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C(=O)N2CCCCC2Cc2nc3cc(F)c(F)cc3n2CCN(C)C)c(-c2ccc(F)cc2)s1

HCID66968433

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74169f242b6e4cf0ad5fd6228d65cb0f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Cl:34][CH2:35][CH2:36][N:37]([CH3:38])[CH3:39].[F:1][c:2]1[cH:3][c:4]2[c:5]([nH:6][c:7]([CH2:9][CH:10]3[N:11]([C:16](=[O:17])[c:18]4[n:19][c:20]([CH3:30])[s:21][c:22]4-[c:23]4[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]4)[CH2:12][CH2:13][CH2:14][CH2:15]3)[n:8]2)[cH:31][c:32]1[F:33]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH2:35][CH2:36][N:37]([CH3:38])[CH3:39])[c:7]([CH2:9][CH:10]3[N:11]([C:16](=[O:17])[c:18]4[n:19][c:20]([CH3:30])[s:21][c:22]4-[c:23]4[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]4)[CH2:12][CH2:13][CH2:14][CH2:15]3)[n:8]2)[cH:31][c:32]1[F:33]