HRID112074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID4519056

4-(Bromomethyl)phenylacetic acid

C9H9BrO2

HCID11065484

5-{[(5-tert-Butyl-1,3-oxazol-2-yl)methyl]sulfanyl}-1,3-thiazol-2-amine

C11H15N3OS2

PRODUCTS

生成物

结构：CC(C)(C)c1cnc(CSc2cnc(NC(=O)Cc3ccc(CBr)cc3)s2)o1

HCID11113601

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cafe53b678c14332beb8287de5c6c1dc
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

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