HRID1207150

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2777399

4-(Trifluoromethyl)benzenesulfonyl chloride

C7H4ClF3O2S

HCID18328928

未命名化合物

PRODUCTS

生成物

结构：O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCC(CN2CCC(c3ccncc3)CC2)CC1

HCID69945207

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1d74c312666467b9aa77a1fdf12c80e
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

[CH2:42]([Cl:43])[Cl:44].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[ClH:15].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[Cl:12])[cH:7][cH:8]1)([F:13])[F:14].[NH:16]1[CH2:17][CH2:18][CH:19]([CH2:22][N:23]2[CH2:24][CH2:25][CH:26]([c:29]3[cH:30][cH:31][n:32][cH:33][cH:34]3)[CH2:27][CH2:28]2)[CH2:20][CH2:21]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[N:16]2[CH2:17][CH2:18][CH:19]([CH2:22][N:23]3[CH2:24][CH2:25][CH:26]([c:29]4[cH:30][cH:31][n:32][cH:33][cH:34]4)[CH2:27][CH2:28]3)[CH2:20][CH2:21]2)[cH:7][cH:8]1)([F:13])[F:14]