HRID1125314

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID943535

2-methyl-5-phenyl-1,3-thiazole-4-carboxylic Acid

C11H9NO2S

HCID178432442

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C(=O)N2CC3CC(C)CC3C2CNC(=O)c2c(C)nc3sccn23)c(-c2ccccc2)s1

HCID178432998

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0f5b4d71ce0a40e789450ead82d167ca
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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