HRID673896

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID82385

Benzoic acid, 4-(chlorosulfonyl)-

C7H5ClO4S

HCID58420580

未命名化合物

PRODUCTS

生成物

结构：O=C(O)c1ccc(S(=O)(=O)Nc2cc3c4c(c2)CCCC4CCC3)cc1

HCID67391147

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e3675cd3ce7c483081051f9acd0d244c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:41][N:42]([CH3:43])[c:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1.[Cl:21][S:22](=[O:23])(=[O:24])[c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]1.[ClH:34].[cH:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[cH:1]1[c:2]([NH2:14])[cH:3][c:4]2[c:13]3[c:12]1[CH2:11][CH2:10][CH2:9][CH:8]3[CH2:7][CH2:6][CH2:5]2.[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[cH:1]1[c:2]([NH:14][S:22](=[O:23])(=[O:24])[c:25]2[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]2)[cH:3][c:4]2[c:13]3[c:12]1[CH2:11][CH2:10][CH2:9][CH:8]3[CH2:7][CH2:6][CH2:5]2