HRID1238019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：NCc1csc2c1S(=O)(=O)N=C(c1c(O)c3ccccc3n(NCC3CC3)c1=O)N2

HCID136358494

未命名化合物

PRODUCTS

生成物

结构：CCS(=O)(=O)NCc1csc2c1S(=O)(=O)N=C(c1c(O)c3ccccc3n(NCC3CC3)c1=O)N2

HCID136347271

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4bf0897f26243749e7755843d952dae
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

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