HRID184111

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID313

Hydrochloric Acid

ClH

HCID1140

Toluene

C7H8

HCID6058

Cysteamine

C2H7NS

HCID8471

Triethylamine

C6H15N

HCID53861051

未命名化合物

PRODUCTS

生成物

HCID54539881

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-24922e2191344b2c982f8c3756a3e1f3
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

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