HRID1546128

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID81531

Diisopropylethylamine

C8H19N

HCID2760919

Cyclopropanesulfonyl chloride

C3H5ClO2S

HCID76834552

未命名化合物

PRODUCTS

产物

HCID76834705

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7a854cadd7a54aff85fd6b2b47aee12f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[CH2:1]([CH:2]=[CH2:3])[C:4]1([CH3:35])[C:5](=[O:34])[N:6]([CH:24]([CH2:25][N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[CH2:32][CH3:33])[CH:7]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1.[CH:36]1([S:39](=[O:40])(=[O:41])[Cl:42])[CH2:37][CH2:38]1.[CH:43]([N:44]([CH:45]([CH3:46])[CH3:47])[CH2:48][CH3:49])([CH3:50])[CH3:51].[OH2:52]>>[CH2:1]([CH:2]=[CH2:3])[C:4]1([CH3:35])[C:5](=[O:34])[N:6]([CH:24]([CH2:25][N:26]2[CH2:27][CH2:28][N:29]([S:39]([CH:36]3[CH2:37][CH2:38]3)(=[O:40])=[O:41])[CH2:30][CH2:31]2)[CH2:32][CH3:33])[CH:7]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1