HRID2136283

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID585879

3-Amino-4-hydroxybenzohydrazide

C7H9N3O2

反应SMILES：COc1cc(OCCN2CCc3ccccc3C2)ccc1C=O

HCID22999143

未命名化合物

PRODUCTS

产物

反应SMILES：COc1cc(OCCN2CCc3ccccc3C2)ccc1C=NNC(=O)c1ccc(O)c(N)c1

HCID72514588

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-13a0d472c0794136829a47c56fec946d
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

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