HRID311417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：CN(c1cccc2cc(C3=NCC(C)(CCO)S3)[nH]c12)S(=O)(=O)c1cccs1

HCID57476112

N-{2-[5-(2-hydroxyethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-yl]-1H-indol-7-yl}-N-methylthiophene-2-sulfonamide

C19H21N3O3S3

PRODUCTS

生成物

结构：CN(c1cccc2cc(C3=NCC(C)(CCOS(C)(=O)=O)S3)[nH]c12)S(=O)(=O)c1cccs1

HCID59135829

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74777f3a7c334b2bbbe6b46fc745db8c
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

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