HRID98600

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3744

1H-Indole-3-propanoic acid

C11H11NO2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12734

Diisopropylcarbodiimide

C7H14N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID18923879

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)Nc1ccc2c(c1)OC(CNCCCc1c[nH]c3ccccc13)CO2

HCID18923867

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c1dd5114726c49539138e91eb20d7991
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:26][CH:27]([N:28]=[C:29]=[N:30][CH:31]([CH3:32])[CH3:33])[CH3:34].[CH3:35][S:36](=[O:37])(=[O:38])[NH:39][c:40]1[cH:41][cH:42][c:43]2[c:44]([cH:51]1)[O:45][CH:46]([CH2:49][NH2:50])[CH2:47][O:48]2.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:15].[OH:16][n:17]1[c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]2[n:24][n:25]1.[nH:1]1[cH:2][c:3]([CH2:10][CH2:11][C:12]([OH:13])=[O:14])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][c:3]([CH2:10][CH2:11][CH2:12][NH:50][CH2:49][CH:46]2[O:45][c:44]3[c:43]([cH:42][cH:41][c:40]([NH:39][S:36]([CH3:35])(=[O:37])=[O:38])[cH:51]3)[O:48][CH2:47]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12