HRID300940

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID240

Benzaldehyde

C7H6O

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID114942

Titanium(4+)

Ti+4

HCID210824

N-Benzyl-2-imino-4-methyl-2,3-dihydro-1,3-thiazole-5-carboximidic acid

C12H13N3OS

HCID498716

未命名化合物

HCID3260420

未命名化合物

4 次

PRODUCTS

生成物

HCID59369679

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-56dc20b6698f47f4b04932caf596f86d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:26]([BH3-:27])#[N:28].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:17])[n:13][c:14]([NH2:16])[s:15]1.[CH3:35][CH:36]([CH3:37])[O-:38].[CH3:40][CH:41]([CH3:42])[O-:43].[CH3:44][CH:45]([CH3:46])[O-:47].[CH3:48][CH:49]([CH3:50])[O-:51].[CH:18](=[O:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[Na+:29].[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1.[Ti+4:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:17])[n:13][c:14]([NH:16][CH2:18][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[s:15]1