HRID2142036

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID962

Water

H2O

HCID9321

Hydrazine

H4N2

结构：Cc1ccc(-c2nc(CCN3C(=O)c4ccccc4C3=O)cn2C(c2nc(C)c(C)c(=O)n2Cc2ccccc2)C(C)C)cc1

HCID21076926

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2nc(CCN)cn2C(c2nc(C)c(C)c(=O)n2Cc2ccccc2)C(C)C)cc1

HCID10389952

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e263928974ca4749a93fbc56c1e29ed6
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:17]([CH:18]([CH3:19])[CH3:20])[n:21]2[c:22](-[c:39]3[cH:40][cH:41][c:42]([CH3:45])[cH:43][cH:44]3)[n:23][c:24]([CH2:26][CH2:27][N:28]3[C:29](=[O:30])[c:31]4[c:32]([cH:33][cH:34][cH:35][cH:36]4)[C:37]3=[O:38])[cH:25]2)[n:10][c:11]([CH3:16])[c:12]([CH3:15])[c:13]1=[O:14].[CH3:49][CH2:50][OH:51].[NH2:47][NH2:48].[OH2:46]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:17]([CH:18]([CH3:19])[CH3:20])[n:21]2[c:22](-[c:39]3[cH:40][cH:41][c:42]([CH3:45])[cH:43][cH:44]3)[n:23][c:24]([CH2:26][CH2:27][NH2:28])[cH:25]2)[n:10][c:11]([CH3:16])[c:12]([CH3:15])[c:13]1=[O:14]