HRID301423

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID10515266

7-methoxynaphthalene-2-sulfonyl Chloride

C11H9ClO3S

HCID18176387

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2ccc(S(=O)(=O)NC3CCN(Cc4ccc5ccnc(Cl)c5c4)C3=O)cc2c1

HCID178487511

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dbff59d631ec4aa1ae1ade6778e6d17c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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