HRID213210

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID135437466

Ethyl 4-oxo-1,4-dihydroquinazoline-2-carboxylate

C11H10N2O3

反应SMILES：NCc1cccc(-c2ccc(CS(=O)(=O)Cc3n[nH]c(=O)[nH]3)cc2)c1

HCID136054470

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(NCc1cccc(-c2ccc(CS(=O)(=O)Cc3n[nH]c(=O)[nH]3)cc2)c1)c1nc2ccccc2c(=O)[nH]1

HCID136054487

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4be07f9c06cc4bf0bff3dfc3185ba007
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:49][CH2:50][OH:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[NH2:1][CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([CH2:15][S:16](=[O:17])(=[O:18])[CH2:19][c:20]3[nH:21][c:22](=[O:25])[nH:23][n:24]3)[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1.[O:26]=[c:27]1[nH:28][c:29]([C:37](=[O:38])[O:39][CH2:40][CH3:41])[n:30][c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]12>>[NH:1]([CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([CH2:15][S:16](=[O:17])(=[O:18])[CH2:19][c:20]3[nH:21][c:22](=[O:25])[nH:23][n:24]3)[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1)[C:37]([c:29]1[nH:28][c:27](=[O:26])[c:36]2[c:31]([n:30]1)[cH:32][cH:33][cH:34][cH:35]2)=[O:38]