HRID165592

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID57717474

tert-Butyl [2-amino-4-(thiophen-2-yl)phenyl]carbamate

C15H18N2O2S

HCID63164457

未命名化合物

PRODUCTS

生成物

结构：CN(C)C1CCN(c2ccc(C(=O)Nc3cc(-c4cccs4)ccc3NC(=O)OC(C)(C)C)cc2)C1

HCID72371137

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4e59194505e24452b167434ee2420922
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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