HRID89869

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID74281

1H-Indole-7-carboxylic acid

C9H7NO2

HCID20694483

未命名化合物

PRODUCTS

生成物

结构：O=C(c1cccc2cc[nH]c12)N1CC(CN2CCC(c3ccccc3)CC2)C(c2ccsc2)C1

HCID18364772

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4da9c268b4894335b704a23559260492
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

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