HRID172834

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID7404

Benzenesulfonyl chloride, 4-nitro-

C6H4ClNO4S

HCID81531

Diisopropylethylamine

C8H19N

HCID4460996

tert-Butyl 1,2,3,4-tetrahydroquinolin-3-ylcarbamate

C14H20N2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1Cc2ccccc2N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1

HCID59400179

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-004c2faef8b34d14bb08e9471c440411
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

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