HRID2131260

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID68288

6-Aminobenzothiazole

C7H6N2S

HCID18470059

3-Benzamidobenzoyl chloride

C14H10ClNO2

PRODUCTS

生成物

结构：O=C(Nc1cccc(C(=O)Nc2ccc3ncsc3c2)c1)c1ccccc1

HCID67005686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-768b0d7f3f424cf09454843462e8a794
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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